Science.gov

Sample records for dialkyl squarate chemistry

  1. Shape assisted fabrication of fluorescent cages of squarate based metal-organic coordination frameworks.

    PubMed

    Jayaramulu, Kolleboyina; Krishna, Katla Sai; George, Subi J; Eswaramoorthy, Muthuswamy; Maji, Tapas Kumar

    2013-05-11

    Micronic cage structures of squarate based metal-organic coordination frameworks (MOCFs) have been fabricated for the first time by specific anion selective etching of metal squarate cubes. Time and stoichiometry dependent synthesis and the corresponding microscopic studies have provided mechanistic insight into the cage formation. Furthermore, a non-covalent post-synthetic strategy has been adopted to functionalize the micronic cubes or cages with chromophores rendering the resulting hybrids green fluorescent.

  2. 40 CFR 721.3437 - Dialkyl ether.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Dialkyl ether. 721.3437 Section 721... Dialkyl ether. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as dialkyl ether (PMN P-93-1308) is subject to reporting under this...

  3. 40 CFR 721.3437 - Dialkyl ether.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Dialkyl ether. 721.3437 Section 721... Dialkyl ether. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as dialkyl ether (PMN P-93-1308) is subject to reporting under this...

  4. Synthesis of N,N'-dialkyl-4'bipyridinium reagents

    DOEpatents

    Wrighton, Mark S.; Bookbinder, Dana C.

    1984-09-25

    A novel class of dialkyl and dialkyl-aromatic viologens (4,4'dipyridinium compounds) and their salts which may be polymerized and covalently bonded to electrodes for use in electronic display systems.

  5. 40 CFR 721.1852 - Di-alkyl borane (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Di-alkyl borane (generic). 721.1852... Substances § 721.1852 Di-alkyl borane (generic). (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as di-alkyl borane (PMN P-00-1087) is...

  6. 40 CFR 721.1852 - Di-alkyl borane (generic).

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Di-alkyl borane (generic). 721.1852... Substances § 721.1852 Di-alkyl borane (generic). (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as di-alkyl borane (PMN P-00-1087) is...

  7. 40 CFR 721.1852 - Di-alkyl borane (generic).

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Di-alkyl borane (generic). 721.1852... Substances § 721.1852 Di-alkyl borane (generic). (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as di-alkyl borane (PMN P-00-1087) is...

  8. 40 CFR 721.1852 - Di-alkyl borane (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Di-alkyl borane (generic). 721.1852... Substances § 721.1852 Di-alkyl borane (generic). (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as di-alkyl borane (PMN P-00-1087) is...

  9. 40 CFR 721.1852 - Di-alkyl borane (generic).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Di-alkyl borane (generic). 721.1852... Substances § 721.1852 Di-alkyl borane (generic). (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified generically as di-alkyl borane (PMN P-00-1087) is...

  10. 40 CFR 721.10314 - Dialkyl dithiocarbamate esters (generic).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Dialkyl dithiocarbamate esters... Specific Chemical Substances § 721.10314 Dialkyl dithiocarbamate esters (generic). (a) Chemical substance... dialkyl dithiocarbamate esters (PMNs P-02-778, P-02-779, and P-02-780) are subject to reporting under...

  11. 40 CFR 721.10314 - Dialkyl dithiocarbamate esters (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Dialkyl dithiocarbamate esters... Specific Chemical Substances § 721.10314 Dialkyl dithiocarbamate esters (generic). (a) Chemical substance... dialkyl dithiocarbamate esters (PMNs P-02-778, P-02-779, and P-02-780) are subject to reporting under...

  12. 40 CFR 721.10560 - Alkanoldioic dialkyl esters (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Alkanoldioic dialkyl esters (generic... Specific Chemical Substances § 721.10560 Alkanoldioic dialkyl esters (generic). (a) Chemical substance and... dialkyl esters (PMNs P-07-143 and P-07-144) are subject to reporting under this section for...

  13. 40 CFR 721.10314 - Dialkyl dithiocarbamate esters (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Dialkyl dithiocarbamate esters... Specific Chemical Substances § 721.10314 Dialkyl dithiocarbamate esters (generic). (a) Chemical substance... dialkyl dithiocarbamate esters (PMNs P-02-778, P-02-779, and P-02-780) are subject to reporting under...

  14. 40 CFR 721.10715 - Carbonic acid, dialkyl ester (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Carbonic acid, dialkyl ester (generic... Specific Chemical Substances § 721.10715 Carbonic acid, dialkyl ester (generic). (a) Chemical substance and..., dialkyl ester (PMN P-13-346) is subject to reporting under this section for the significant new...

  15. 40 CFR 721.10560 - Alkanoldioic dialkyl esters (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Alkanoldioic dialkyl esters (generic... Specific Chemical Substances § 721.10560 Alkanoldioic dialkyl esters (generic). (a) Chemical substance and... dialkyl esters (PMNs P-07-143 and P-07-144) are subject to reporting under this section for...

  16. 40 CFR 721.10099 - Dialkyl dimethyl ammonium carbonate (generic).

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Dialkyl dimethyl ammonium carbonate... Specific Chemical Substances § 721.10099 Dialkyl dimethyl ammonium carbonate (generic). (a) Chemical... as dialkyl dimethyl ammonium carbonate (1:1) (PMN P-03-715) is subject to reporting under...

  17. 40 CFR 721.10099 - Dialkyl dimethyl ammonium carbonate (generic).

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Dialkyl dimethyl ammonium carbonate... Specific Chemical Substances § 721.10099 Dialkyl dimethyl ammonium carbonate (generic). (a) Chemical... as dialkyl dimethyl ammonium carbonate (1:1) (PMN P-03-715) is subject to reporting under...

  18. Catalytic enantioselective synthesis of vicinal dialkyl arrays.

    PubMed

    van Zijl, Anthoni W; Szymanski, Wiktor; López, Ferrnando; Minnaard, Adriaan J; Feringa, Ben L

    2008-09-19

    With a consecutive "asymmetric allylic alkylation (AAA)/cross-metathesis (CM)/conjugate addition (CA)" protocol it is possible to synthesize either stereoisomer of compounds containing a vicinal dialkyl array with excellent stereoselectivity. The versatility of this protocol in natural product synthesis is demonstrated in the preparation of the ant pheromones faranal and lasiol. PMID:18683977

  19. 40 CFR 721.10438 - Dialkyl hydroxybenzenealkanoic acid ester (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... ester (generic). 721.10438 Section 721.10438 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY... Specific Chemical Substances § 721.10438 Dialkyl hydroxybenzenealkanoic acid ester (generic). (a) Chemical... as dialkyl hydroxybenzenealkanoic acid ester (PMN P-00-346) is subject to reporting under...

  20. 40 CFR 721.10438 - Dialkyl hydroxybenzenealkanoic acid ester (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... ester (generic). 721.10438 Section 721.10438 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY... Specific Chemical Substances § 721.10438 Dialkyl hydroxybenzenealkanoic acid ester (generic). (a) Chemical... as dialkyl hydroxybenzenealkanoic acid ester (PMN P-00-346) is subject to reporting under...

  1. Biodegradation of the anionic surfactant dialkyl sulphosuccinate

    SciTech Connect

    Hales, S.G. . Port Sunlight Lab.)

    1993-10-01

    A range of Organization for Economic Cooperation and Development (OECD) guideline test systems was used to determine the extent and possible mechanisms of biodegradation of dialkyl sulphosuccinate (DASS, C[sub 6]/C[sub 8]). Primary biodegradation of DASS was virtually complete in OECD guideline tests and in simulations of activated sludge sewage treatment systems under both optimal and adverse conditions, and of an anaerobic digester. Ultimate biodegradation increased form about 50% in ready tests to 94% in more powerful inherent tests. [[sup 14]C]DASS was used to determine the fate of the surfactant in activated sludge and in surface waters. Mechanistic studies were performed to ascertain the biodegradative pathway of [[sup 14]C]DASS. A putative degradation pathway for DASS is proposed.

  2. 40 CFR 721.10125 - Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and alkenoic acid...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ..., reaction products with polyaminocarbomonocycle and alkenoic acid alkyl ester (generic). 721.10125 Section... Substances § 721.10125 Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and.... (1) The chemical substances identified generically as alkenedioic acid, dialkyl ester,...

  3. 40 CFR 721.10125 - Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and alkenoic acid...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ..., reaction products with polyaminocarbomonocycle and alkenoic acid alkyl ester (generic). 721.10125 Section... Substances § 721.10125 Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and.... (1) The chemical substances identified generically as alkenedioic acid, dialkyl ester,...

  4. 40 CFR 721.10125 - Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and alkenoic acid...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ..., reaction products with polyaminocarbomonocycle and alkenoic acid alkyl ester (generic). 721.10125 Section... Substances § 721.10125 Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and.... (1) The chemical substances identified generically as alkenedioic acid, dialkyl ester,...

  5. 40 CFR 721.10125 - Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and alkenoic acid...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ..., reaction products with polyaminocarbomonocycle and alkenoic acid alkyl ester (generic). 721.10125 Section... Substances § 721.10125 Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and.... (1) The chemical substances identified generically as alkenedioic acid, dialkyl ester,...

  6. 40 CFR 721.10125 - Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and alkenoic acid...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ..., reaction products with polyaminocarbomonocycle and alkenoic acid alkyl ester (generic). 721.10125 Section... Substances § 721.10125 Alkenedioic acid, dialkyl ester, reaction products with polyaminocarbomonocycle and.... (1) The chemical substances identified generically as alkenedioic acid, dialkyl ester,...

  7. 40 CFR 721.10100 - Dialkyl dimethyl ammonium carbonate (2:1) (generic).

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 40 Protection of Environment 31 2011-07-01 2011-07-01 false Dialkyl dimethyl ammonium carbonate (2... Specific Chemical Substances § 721.10100 Dialkyl dimethyl ammonium carbonate (2:1) (generic). (a) Chemical... as dialkyl dimethyl ammonium carbonate (2:1) (PMN P-03-716) is subject to reporting under...

  8. 40 CFR 721.10100 - Dialkyl dimethyl ammonium carbonate (2:1) (generic).

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Dialkyl dimethyl ammonium carbonate (2... Specific Chemical Substances § 721.10100 Dialkyl dimethyl ammonium carbonate (2:1) (generic). (a) Chemical... as dialkyl dimethyl ammonium carbonate (2:1) (PMN P-03-716) is subject to reporting under...

  9. Safety Assessment of Dialkyl Malates as Used in Cosmetics.

    PubMed

    Becker, Lillian C; Bergfeld, Wilma F; Belsito, Donald V; Hill, Ronald A; Klaassen, Curtis D; Liebler, Daniel C; Marks, James G; Shank, Ronald C; Slaga, Thomas J; Snyder, Paul W; Andersen, F Alan

    2015-01-01

    The Cosmetic Ingredient Review Expert Panel (Panel) reviewed the safety of 6 dialkyl malate compounds used in cosmetics. These ingredients function mostly as skin-conditioning agents-emollients. The Panel reviewed relevant animal and human data related to the ingredients along with a previous safety assessment of malic acid. The similar structure, properties, functions, and uses of these ingredients enabled grouping them and using the available toxicological data to assess the safety of the entire group. The Panel concluded that these dialkyl maleate compounds are safe in the present practices of use and concentration as given in this safety assessment.

  10. Dialkyl 3,3'-thiodipropionate and dialkyl 2,2'-thiodiacetate antioxidants by lipase-catalyzed esterification and transesterification.

    PubMed

    Weber, Nikolaus; Klein, Erika; Vosmann, Klaus

    2006-04-19

    Medium- and long-chain dialkyl 3,3'-thiodipropionate antioxidants such as dioctyl 3,3'-thiodipropionate, didodecyl 3,3'-thiodipropionate, dihexadecyl 3,3'-thiodipropionate, and di-(cis-9-octadecenyl) 3,3'-thiodipropionate were prepared in high yield by lipase-catalyzed esterification and transesterification of 3,3'-thiodipropionic acid and its dimethyl ester, respectively, with the corresponding medium- or long-chain 1-alkanols, i.e., 1-octanol, 1-dodecanol, 1-hexadecanol, and cis-9-octadecen-1-ol, in vacuo (80 kPa) at moderate temperatures (60-80 degrees C) without solvents. Immobilized lipase B from Candida antarctica (Novozym 435) was the most active biocatalyst for the preparation of medium- and long-chain dialkyl 3,3'-thiodipropionates showing enzyme activities up to 1489 units/g, whereas the immobilized lipases from Rhizomucor miehei (Lipozyme RM IM) and Thermomyces lanuginosus (Lipozyme TL IM) were by far less active ( approximately 10 enzyme units/g). Maximum conversions to dialkyl 3,3'-thiodipropionates were as high as 92-98% after 4 h of reaction time. Similarly, dihexadecyl 2,2'-thiodiacetate was prepared in high yield using 2,2'-thiodiacetic acid or diethyl 2,2'-thiodiacetate and 1-hexadecanol as the starting materials and Novozym 435 as the biocatalyst. PMID:16608215

  11. 40 CFR 721.10342 - Quaternary ammonium compounds, fatty alkyl dialkyl hydroxide (generic).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... alkyl dialkyl hydroxide (generic). 721.10342 Section 721.10342 Protection of Environment ENVIRONMENTAL... Significant New Uses for Specific Chemical Substances § 721.10342 Quaternary ammonium compounds, fatty alkyl... chemical substance identified generically as quaternary ammonium compounds, fatty alkyl dialkyl...

  12. 40 CFR 721.10342 - Quaternary ammonium compounds, fatty alkyl dialkyl hydroxide (generic).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... alkyl dialkyl hydroxide (generic). 721.10342 Section 721.10342 Protection of Environment ENVIRONMENTAL... Significant New Uses for Specific Chemical Substances § 721.10342 Quaternary ammonium compounds, fatty alkyl... chemical substance identified generically as quaternary ammonium compounds, fatty alkyl dialkyl...

  13. 40 CFR 721.10342 - Quaternary ammonium compounds, fatty alkyl dialkyl hydroxide (generic).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... alkyl dialkyl hydroxide (generic). 721.10342 Section 721.10342 Protection of Environment ENVIRONMENTAL... Significant New Uses for Specific Chemical Substances § 721.10342 Quaternary ammonium compounds, fatty alkyl... chemical substance identified generically as quaternary ammonium compounds, fatty alkyl dialkyl...

  14. 40 CFR 721.10413 - Fluorinated dialkyl ketone (generic) (P-10-135).

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ...) (P-10-135). 721.10413 Section 721.10413 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY... Specific Chemical Substances § 721.10413 Fluorinated dialkyl ketone (generic) (P-10-135). (a) Chemical... as fluorinated dialkyl ketone (PMN P-10-135) is subject to reporting under this section for...

  15. 40 CFR 721.10413 - Fluorinated dialkyl ketone (generic) (P-10-135).

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ...) (P-10-135). 721.10413 Section 721.10413 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY... Specific Chemical Substances § 721.10413 Fluorinated dialkyl ketone (generic) (P-10-135). (a) Chemical... as fluorinated dialkyl ketone (PMN P-10-135) is subject to reporting under this section for...

  16. 40 CFR 721.10413 - Fluorinated dialkyl ketone (generic) (P-10-135).

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ...) (P-10-135). 721.10413 Section 721.10413 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY... Specific Chemical Substances § 721.10413 Fluorinated dialkyl ketone (generic) (P-10-135). (a) Chemical... as fluorinated dialkyl ketone (PMN P-10-135) is subject to reporting under this section for...

  17. Methods of producing sulfate salts of cations from heteroatomic compounds and dialkyl sulfates and uses thereof

    SciTech Connect

    Friesen, Cody A.; Wolfe, Derek; Johnson, Paul Bryan

    2015-09-29

    Methods of preparing sulfate salts of heteroatomic compounds using dialkyl sulfates as a primary reactant are disclosed. Also disclosed are methods of making ionic liquids from the sulfate salts of the heteroatomic compound, and electrochemical cells comprising the ionic liquids.

  18. Calibrating the glycerol dialkyl glycerol tetraether temperature signal in speleothems

    NASA Astrophysics Data System (ADS)

    Blyth, Alison J.; Schouten, Stefan

    2013-05-01

    Palaeotemperature proxies based on glycerol dialkyl glycerol tetraethers (GDGTs) lipids have been established for marine and lacustrine environments, but there has been relatively little study of their application in speleothems. In this study we analyse the GDGT content of 33 speleothem samples from 16 different sites around the globe, and test whether proxies based on isoprenoid tetraethers (TEX86) or branched tetraethers (MBT/CBT) are correlated with measured surface and cave mean annual air temperature (MAT). The results show that the TEX86 has a strong relationship with measured temperature (r2 = 0.78, standard error of the estimate 2.3 °C, when calibrated with surface MAT). Furthermore, the MBT/CBT also showed a significant relationship with temperature (r2 = 0.73, standard error of the estimate 2.7 °C, when calibrated with surface MAT). Some issues remain requiring future work, in particular the development of a larger calibration sample set with measured cave temperature data, and the investigation of controls other than temperature on GDGT distribution, but overall the results indicate that GDGT based proxies derived from speleothems may be highly viable new methods for reconstructing continental palaeotemperatures.

  19. 40 CFR 721.10381 - Cyclic carboxylic acid, polymer with dihydroxy dialkyl ether, hydroxy substituted alkane and...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Cyclic carboxylic acid, polymer with dihydroxy dialkyl ether, hydroxy substituted alkane and carboxylic acid anhydride, methacrylate terminated... Specific Chemical Substances § 721.10381 Cyclic carboxylic acid, polymer with dihydroxy dialkyl...

  20. 40 CFR 721.10381 - Cyclic carboxylic acid, polymer with dihydroxy dialkyl ether, hydroxy substituted alkane and...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Cyclic carboxylic acid, polymer with dihydroxy dialkyl ether, hydroxy substituted alkane and carboxylic acid anhydride, methacrylate terminated... Specific Chemical Substances § 721.10381 Cyclic carboxylic acid, polymer with dihydroxy dialkyl...

  1. 40 CFR 721.10381 - Cyclic carboxylic acid, polymer with dihydroxy dialkyl ether, hydroxy substituted alkane and...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Cyclic carboxylic acid, polymer with dihydroxy dialkyl ether, hydroxy substituted alkane and carboxylic acid anhydride, methacrylate terminated... Specific Chemical Substances § 721.10381 Cyclic carboxylic acid, polymer with dihydroxy dialkyl...

  2. 40 CFR 721.10664 - Alkenedioic acid dialkyl ester, reaction products with alkenoic acid alkyl esters and diamine...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ..., reaction products with alkenoic acid alkyl esters and diamine (generic). 721.10664 Section 721.10664... Alkenedioic acid dialkyl ester, reaction products with alkenoic acid alkyl esters and diamine (generic). (a... generically as alkenedioic acid dialkyl ester, reaction products with alkenoic acid alkyl esters and...

  3. 40 CFR 721.10664 - Alkenedioic acid dialkyl ester, reaction products with alkenoic acid alkyl esters and diamine...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ..., reaction products with alkenoic acid alkyl esters and diamine (generic). 721.10664 Section 721.10664... Alkenedioic acid dialkyl ester, reaction products with alkenoic acid alkyl esters and diamine (generic). (a... generically as alkenedioic acid dialkyl ester, reaction products with alkenoic acid alkyl esters and...

  4. Spectroscopic investigation of the structures of dialkyl tartrates and their cyclodextrin complexes.

    PubMed

    Zhang, Peng; Polavarapu, Prasad L

    2007-02-01

    Structures of three dialkyl tartrates, namely, dimethyl tartrate, diethyl tartrate, and diisopropyl tartrate, in CCl4, dimethyl sulfoxide (DMSO)/DMSO-d6, and H2O/D2O solvents have been investigated using vibrational absorption (VA), vibrational circular dichroism (VCD), and optical rotatory dispersion (ORD). VA, VCD, and ORD spectra are found to be dependent on the solvent used. Density functional theory (DFT) calculations are used to interpret the experimental data in CCl4 and DMSO. The trans-COOR conformer with hydrogen bonding between the OH group and the C=O group attached to the same chiral carbon is dominant for dialkyl tartrates both in vacuum and in CCl4. The experimental VA, VCD, and ORD data of dialkyl-D-tartrates in CCl4 correlated well with those predicted for dimethyl-(S,S)-tartrate molecule as both isolated and solvated in CCl4. In DMSO solvent, dialkyl tartrate molecules favor formation of intermolecular hydrogen bonding with DMSO molecules. Clusters of dimethyl-(S,S)-tartrate, with one molecule of dimethyl-(S,S)-tartrate hydrogen bonded to two DMSO molecules, are used for the DFT calculations. A trans-COOR cluster and a trans-H cluster are needed to obtain a reasonable agreement between the predicted and experimental data of dimethyl tartrate in DMSO solvent. VA, VCD, and optical rotations are also measured for dialkyl tartrate-cyclodextrin complexes. It is noted that these properties are barely affected by complexation of dialkyl tartrates with cyclodextrins, indicating weak interaction between tartrates and cyclodextrin. Binding constants of alpha-CD and beta-CD with diethyl L-tartrate in both H2O and DMSO have been determined using isothermal titration calorimetry technique. The smaller binding constants (less than 100) confirmed the weak interaction between tartrates and cyclodextrin in the solution state.

  5. Surface reaction of dialkyl phosphite on alumina and magnesia studied by inelastic electron tunneling spectroscopy

    SciTech Connect

    Higo, Morihide; Kamata, Satsuo )

    1990-11-29

    Vibrational spectra of dimethyl, diethyl, and diphenyl phosphite on alumina and magnesia surfaces have been measured by inelastic electron tunneling spectroscopy. These dialkyl phosphites (O,O-dialkyl phosphonates) were adsorbed onto Al{sub 2}O{sub 3} and MgO surfaces from anhydrous benzene solutions by using a spin doping method. The tunneling spectra of phosphorous acid (phosphonic acid) on Al{sub 2}O{sub 3} have also been measured for comparison. Phosphorous acid reacts with surface OH groups of Al{sub 2}O{sub 3} by losing its protons and is adsorbed as phosphite anion (phosphonate dianion) onto the surface. Analysis of the tunneling spectra and comparison of the infrared and Raman spectra of the dialkyl phosphites give information about their molecular structures on Al{sub 2}O{sub 3} and MgO and a surface reaction on them. These dialkyl phosphites decompose by a reaction with the surface OH groups on Al{sub 2}O{sub 3} and MgO to give the adsorbed O-alkyl phosphonate monoanions and phosphonate dianion. The similarity of the tunneling spectra of dimethyl phosphite and that of phosphorous acid suggests that dimethyl phosphite decomposes rapidly to give preferentially the adsorbed phosphonate dianion on the surfaces.

  6. Base-catalyzed bicyclization of dialkyl glutaconates with cinnamoylacetamides: a synthetic strategy for isoquinolinedione derivatives.

    PubMed

    Li, Lei; Zhao, Yu-Long; Wang, He; Li, Yi-Jin; Xu, Xianxiu; Liu, Qun

    2014-06-21

    We report here that polysubstituted dihydroisoquinolones and isoquinolones can be constructed by the one-pot reaction of the readily available acyclic α,β-unsaturated carbonyl precursors and dialkyl glutaconates under mild basic conditions (1-45 min for the former vs. 1-6 h for the latter) via the domino process involving [3+3] annulation/intramolecular aza-cyclization.

  7. Distribution coefficients of purine alkaloids in water-ammonium sulfate-alkyl acetate-dialkyl phthalate systems

    NASA Astrophysics Data System (ADS)

    Korenman, Ya. I.; Krivosheeva, O. A.; Mokshina, N. Ya.

    2012-12-01

    The distribution of purine alkaloids (caffeine, theobromine, theophylline) was studied in the systems: alkyl acetates-dialkyl phtalate-salting-out agent (ammonium sulfate). The quantitative characteristics of the extraction-distribution coefficients ( D) and the degree of extraction ( R, %) are calculated. The relationships between the distribution coefficients of alkaloids and the length of the hydrocarbon radical in the molecule of alkyl acetate (dialkyl phtalate) are determined. The possibility of predicting the distribution coefficients is demonstrated.

  8. Dewaxing waxy hydrocarbon oils using di-alkyl fumarate-vinyl laurate copolymer dewaxing aids

    SciTech Connect

    Achia, B.U.; DeKraker, A.R.; Rossi, A.

    1986-06-10

    A method is described for dewaxing waxy hydrocarbon oils comprising mixing the waxy hydrocarbon oil feedstock with a dewaxing solvent and a dewaxing aid, the dewaxing aid comprising (A) a dialkyl fumarate-vinyl laurate copolymer having a number average molecular weight of about 30,000 or more, as determined by gel permeation chromatography; and (B) a second component selected from a wax-naphthalene condensation copolymer, dialkyl fumarate-vinyl acetate copolymer or an ethylene-vinyl acetate copolymer, components (A) and (B) being used in a ratio of (A) to (B) of 2/1 to 1/1, chilling the waxy hydrocarbon oil/dewaxing solvent/dewaxing aid combination to precipitate solid particles of wax therefrom, producing a slurry of wax/dewaxed oil dewaxing solvent/dewaxing aid, and separating the wax from the slurry and recovering a dewaxed oil.

  9. Final safety assessment of thiodipropionic acid and its dialkyl esters as used in cosmetics.

    PubMed

    Diamante, Catherine; Fiume, Monice Zondlo; Bergfeld, Wilma F; Belsito, Donald V; Hill, Ronald A; Klaassen, Curtis D; Liebler, Daniel C; Marks, James G; Shank, Ronald C; Slaga, Thomas J; Snyder, Paul W; Alan Andersen, F

    2010-07-01

    Dilauryl thiodipropionate (DLTDP), dicetyl thiodipropionate, dimyristyl thiodipropionate, distearyl thiodipropionate, and ditridecyl thiodipropionate are dialkyl esters of their respective alcohols and thiodipropionic acid (TDPA) used in cosmetics. Ingested DLTDP was excreted in the urine as TDPA. Single-dose acute oral and parenteral studies and subchronic and chronic repeated dose oral studies did not suggest significant toxicity. Neither DLTDP nor TDPA was irritating to animal skin or eyes and they were not sensitizers. TDPA was neither a teratogen nor a reproductive toxicant. Genotoxicity studies were negative for TDPA and DLTDP. Clinical testing demonstrated some evidence of irritation but no sensitization or photosensitization. The Cosmetic Ingredient Review Expert Panel considered that the data from DLTDP reasonably may be extrapolated to the other dialkyl esters and concluded that these ingredients were safe for use in cosmetic products that are formulated to be nonirritating.

  10. Enantioselective synthesis of hindered cyclic dialkyl ethers via catalytic oxa-Michael/Michael desymmetrization†

    PubMed Central

    Corbett, Michael T.; Johnson, Jeffrey S.

    2014-01-01

    An asymmetric oxa-Michael/Michael cascade reaction of p-quinols and α,β-unsaturated aldehydes provides access to hindered dialkyl ethers. A highly enantioselective oxa-Michael addition of a tertiary alcohol precedes an intramolecular cyclohexadienone desymmetrization, which allows for the concomitant formation of four contiguous stereocenters in a single step. The highly functionalized bicyclic frameworks are rapidly obtained from simple starting materials with good diastereoselection and serve as valuable precursors for further manipulation. PMID:24683449

  11. Identification of O,O-dialkyl-S-methylphosphorodithioate residues in fish.

    PubMed

    Yurawecz, M P; Puma, B J

    1986-01-01

    O,O-Dialkyl-S-methylphosphorodithioates were found in Mississippi River buffalo fish caught near several chemical plants and oil refineries in Hartford and Wood River, IL. These chemicals, which have not been previously recognized as environmental or food contaminants, were identified and quantitated by a procedure similar to the AOAC multiresidue method for organochlorine and organophosphorus pesticides, using gas chromatography (GC) with flame photometric detection (FPD). The key to their identification was a GC/FPD retention time pattern that was virtually the same as that for the diazomethane reaction products of a commercial zinc dialkyl dithiophosphate motor oil additive. GC/mass spectrometry (MS) showed that the compound producing the largest GC/FPD peak contained butoxy groups. The identification of this compound as O,O-di(2-methylpropyl)-S-methyl-phosphorodithioate (Compound C) was confirmed by GC/MS analysis by comparison with the authentic material. The buffalo fish contained 0.15 ppm Compound C and 0.5 ppm total O,O-dialkyl-S-methylphosphorodithioates. Subsequent analyses of fish from other areas showed that these contaminants were not limited to the Hartford-Wood River area. Lower residue levels of Compound C, ranging from 0.01 to 0.05 ppm, were found in fish from the Mississippi River at Sauget, IL, and from the Delaware River and Newark Bay in NJ.

  12. Identification of O,O-dialkyl-S-methylphosphorodithioate residues in fish

    SciTech Connect

    Yurawecz, M.P.; Puma, B.J.

    1986-03-01

    O,O-Dialkyl-S-methylphosphorodithioates were found in Mississippi River buffalo fish caught near several chemical plants and oil refineries in Hartford and Wood River, IL. These chemicals, which have not been previously recognized as environmental or food contaminants, were identified and quantitated by a procedure similar to the AOAC multiresidue method for organochlorine and organophosphorus pesticides, using gas chromatography (GC) with flame photometric detection (FPD). The key to their identification was a GC/FPD retention time pattern that was virtually the same as that for the diazomethane reaction products of a commercial zinc dialkyl dithiophosphate motor oil additive. GC/mass spectrometry (MS) showed that the compound producing the largest GC/FPD peak contained butoxy groups. The identification of this compound as O,O-di(2-methylpropyl)-S-methyl-phosphorodithioate (Compound C) was confirmed by GC/MS analysis by comparison with the authentic material. The buffalo fish contained 0.15 ppm Compound C and 0.5 ppm total O,O-dialkyl-S-methylphosphorodithioates. Subsequent analyses of fish from other areas showed that these contaminants were not limited to the Hartford-Wood River area. Lower residue levels of Compound C, ranging from 0.01 to 0.05 ppm, were found in fish from the Mississippi River at Sauget, IL, and from the Delaware River and Newark Bay in NJ.

  13. Enantioselective Synthesis of Dialkylated α-Hydroxy Carboxylic Acids through Asymmetric Phase-Transfer Catalysis.

    PubMed

    Duan, Shaobo; Li, Sanliang; Ye, Xinyi; Du, Nuan-Nuan; Tan, Choon-Hong; Jiang, Zhiyong

    2015-08-01

    In the presence of an L-tert-leucine-derived urea-ammonium salt as phase-transfer catalyst, a highly enantioselective alkylation of 5H-oxazol-4-ones with various benzyl bromides and allylic bromides has been developed to furnish catalytic asymmetric synthesis of biologically important dialkylated α-hydroxy carboxylic acids with a broad scope. This is the first example of an L-amino acid-derived urea-ammonium salt being used as a phase-transfer catalyst with excellent catalytic efficiency.

  14. Structure-Activity Studies on Nematicidal Activity of Dialkyl Carbamates and Thiocarbamates

    PubMed Central

    Kochansky, Jan; Feldmesser, Julius

    1989-01-01

    In laboratory tests, 129 dialkyl carbamates of types ROC(O)NHR', RSC(O)NHR', and ROC(S)NHR' were tested in a screening bioassay against Panagrellus redivivus. The 10 most active were lethal at concentrations from 5 ppm down to ca. 1 ppm. Eight of these (the only ones active below 2.5 ppm) were thiolcarbamates (RSC(O)NHR'). Decyl N-methyhhiolcarbamate was also lethal to Meloidogyne incognita at approximately 1 ppm in direct contact tests. PMID:19287593

  15. The use of dialkyl fumarate-vinyl acetate copolymers as dewaxing aids

    SciTech Connect

    Dekraker, A.R.; Martella, D.J.

    1987-06-02

    This patent describes a dewaxing process wherein a dewaxing aid is mixed with a waxy petroleum stock and solvent, and chilled to produce a slurry comprising dewaxed oil and solvent along with solid particles of wax, and filtered to separate the dewaxed oil and solvent from the wax particles. The improvement comprises using as a dewaxing aid a copolymer of dialkyl fumarate and vinyl acetate having a Specific Viscosity measured at 2 wt.% solution in xylene at 40/sup 0/C of at least 2.5, and wherein 50 to 100 wt.% of the alkyl groups are C/sub 20/ to C/sub 24/ alkyl groups.

  16. From ether to acid: A plausible degradation pathway of glycerol dialkyl glycerol tetraethers

    NASA Astrophysics Data System (ADS)

    Liu, Xiao-Lei; Birgel, Daniel; Elling, Felix J.; Sutton, Paul A.; Lipp, Julius S.; Zhu, Rong; Zhang, Chuanlun; Könneke, Martin; Peckmann, Jörn; Rowland, Steven J.; Summons, Roger E.; Hinrichs, Kai-Uwe

    2016-06-01

    Glycerol dialkyl glycerol tetraethers (GDGTs) are ubiquitous microbial lipids with extensive demonstrated and potential roles as paleoenvironmental proxies. Despite the great attention they receive, comparatively little is known regarding their diagenetic fate. Putative degradation products of GDGTs, identified as hydroxyl and carboxyl derivatives, were detected in lipid extracts of marine sediment, seep carbonate, hot spring sediment and cells of the marine thaumarchaeon Nitrosopumilus maritimus. The distribution of GDGT degradation products in environmental samples suggests that both biotic and abiotic processes act as sinks for GDGTs. More than a hundred newly recognized degradation products afford a view of the stepwise degradation of GDGT via (1) ether bond hydrolysis yielding hydroxyl isoprenoids, namely, GDGTol (glycerol dialkyl glycerol triether alcohol), GMGD (glycerol monobiphytanyl glycerol diether), GDD (glycerol dibiphytanol diether), GMM (glycerol monobiphytanol monoether) and bpdiol (biphytanic diol); (2) oxidation of isoprenoidal alcohols into corresponding carboxyl derivatives and (3) chain shortening to yield C39 and smaller isoprenoids. This plausible GDGT degradation pathway from glycerol ethers to isoprenoidal fatty acids provides the link to commonly detected head-to-head linked long chain isoprenoidal hydrocarbons in petroleum and sediment samples. The problematic C80 to C82 tetraacids that cause naphthenate deposits in some oil production facilities can be generated from H-shaped glycerol monoalkyl glycerol tetraethers (GMGTs) following the same process, as indicated by the distribution of related derivatives in hydrothermally influenced sediments.

  17. Beyond paraquats: dialkyl 3,3'- and 3,4'-bipyridinium amphiphiles as antibacterial agents.

    PubMed

    Ator, Laura E; Jennings, Megan C; McGettigan, Amanda R; Paul, Jared J; Wuest, William M; Minbiole, Kevin P C

    2014-08-15

    Dialkyl 4,4'-bipyridinium compounds, known as 'paraquats' (PQs), have a long history of use as herbicides, as redox indicators, and more recently as potent antibacterial agents. However, due to their ability to form reactive oxygen species (ROS) in vivo, PQs are also known to be toxic. We proposed that altering the electrochemical properties of PQ, specifically by preparing isomeric bipyridinium structures with 3,3'- and 3,4'-substitution of the nitrogen heteroatoms on the biaryl core, would maintain antibacterial activity, yet decrease toxicity. We have thus prepared a series of 17 amphiphiles, dubbed 'metaquat' (MQ) and 'parametaquat' (PMQ), respectively, and investigated their antibacterial and electrochemical properties. Optimal inhibition of bacterial growth was observed in symmetric, biscationic structures; minimum inhibitory concentration (MIC) values measured as low as 0.5 μM against both Gram-positive and Gram-negative bacteria for the compound PMQ-11,11. Electrochemical analysis demonstrated the redox properties of the dialkyl 3,3'- and 3,4'-bipyridinium amphiphiles to be distinct from those of the 4,4'-bipyridinium isomer. Thus MQ and PMQ amphiphiles maintain the strong antibacterial activity of the PQ isomers, but show promise for reduced ROS toxicity. PMID:25082127

  18. Synthesis of MCM-41 molecular sieves in the presence of dialkyl dimethyl ammonium salts

    SciTech Connect

    Karra, V.R.; Sayari, A.

    1995-12-01

    In the synthesis of MCM-41 mesoporous molecular sieves the chain length of the surfactant template plays a major role in determining the pore dimensions of the resulting material. The effect of the bulkiness of quaternary ammonium template on the pore size of mesoporous silicates has been studied using various dialkyl dimethyl ammonium bromide salts. These templates were prepared by refluxing long chain N,N-dimethyl alkyl amines and bromo alkanes for 24 h. The obtained silicates were characterized by various techniques including XRD, nitrogen and benzene adsorption, FTIR, {sup 29}Si MAS NMR and electron microscopy. The relationship between the length of both alkyl groups and the pore size of the material will be presented.

  19. Aggregation of dialkyl-substituted diphosphonic acids and its effect on metal ion extraction.

    SciTech Connect

    Chiarizia, R.; Barrans, R. E., Jr.; Ferraro, J. R. Herlinger, A. W.; McAlister, D. R.

    1999-10-22

    Solvent extraction reagents containing the diphosphonic acid group exhibit an extraordinary affinity for tri-, tetra- and hexavalent actinides. Their use has been considered for actinide separation and pre-concentration procedures. Solvent extraction data obtained with P,P{prime}-di(2-ethylhexyl) methane-, ethane- and butanediphosphonic acids exhibit features that are difficult to explain without Knowledge of the aggregation state of the extractants. Information about the aggregation of the dialkyl-substituted diphosphonic acids in aromatic diluents has been obtained using the complementary techniques of vapor pressure osmometry (VPO), small angle neutron scattering (SANS), infrared spectroscopy and molecular mechanics. The results from these techniques provide an understanding of the aggregation behavior of these extractants that is fully compatible with the solvent extraction data. The most important results and their relevance to solvent extraction are reviewed in this paper.

  20. Sodium hydroxide catalyzed N-alkylation of (hetero) aromatic primary amines and N1,C5-dialkylation of 4-phenyl-2-aminothiazoles with benzyl alcohols.

    PubMed

    Donthiri, Ramachandra Reddy; Pappula, Venkatanarayana; Mohan, Darapaneni Chandra; Gaywala, Hiren H; Adimurthy, Subbarayappa

    2013-07-01

    In the presence of a catalytic amount of NaOH, the selective N-alkylation of various heteroaromatic primary amines is reported. With 1 equiv of NaOH, N1,C5-dialkylation of 4-phenyl-2-aminothiazoles has been investigated. Reaction of in situ generated aldehyde with amine yields the N-alkylated and N1,C5-dialkylated products through hydride ion transformation from alcohol.

  1. Mono(boratabenzene) rare-earth metal dialkyl complexes: synthesis, structure and catalytic behaviors for styrene polymerization.

    PubMed

    Wang, Xiufang; Leng, Xuebing; Chen, Yaofeng

    2015-03-28

    Four mono(boratabenzene) rare-earth metal dialkyl complexes, [(3,5-Me2-C5H3BR)Ln(CH2SiMe3)2(THF)] (1: R = NEt2, Ln = Sc; 2: R = NEt2, Ln = Lu; 3: R = Ph, Ln = Sc; 4: R = Ph, Ln = Lu), were synthesized efficiently via a one-pot strategy with Li[3,5-Me2-C5H3BR] (R = NEt2, Ph), LnCl3(THF)x (Ln = Sc, x = 3; Ln = Lu, x = 0), and LiCH2SiMe3. The solid-state structures of 1 and 2 were determined by single-crystal X-ray diffraction. Variable-temperature NMR studies indicated that the energy barrier for the rotation of aminoboratabenzene in 1 (ΔG‡ ≈ 71 kJ mol−1) is higher than that of phenylboratabenzene in 3 (ΔG‡ ≈ 59 kJ mol−1). These mono(boratabenzene) rare-earth metal dialkyl complexes’ catalytic behaviors for styrene polymerization were investigated, and found that mono(boratabenzene) scandium dialkyl complexes show high catalytic activities for syndiotactic polymerization upon activation with cocatalysts.

  2. Effect of biochar aging on surface characteristics and adsorption behavior of dialkyl phthalates.

    PubMed

    Ghaffar, Abdul; Ghosh, Saikat; Li, Fangfang; Dong, Xudong; Zhang, Di; Wu, Min; Li, Hao; Pan, Bo

    2015-11-01

    The implications of biochar aging regarding their material properties as well as their interactions with other contaminants are not vivid. We report the role of biochar aging on sorption behavior of di-alkyl phthalates (PAEs). Biochars used in this study were produced from peanut-shell and their aging was simulated by chemical oxidation. The structural composition and morphology of the obtained biochars, before and after oxidation with HNO3/H2SO4, were analyzed by element composition, XPS, DRIFT, and SEM/EDX. Several experimental results unequivocally showed oxygen enrichment in the mixed acid treated samples compared to their precursors. Despite surface area reduction and pore destruction, increased PAEs sorption on oxidized biochar surfaces portrayed existence of strong PAEs binding sites. The adsorption of PAEs on oxidized biochar surface is a cumulative influence of hydrophobic interactions and pi-pi electron donor-acceptor interactions. Our results suggest that imminent aging of biochar upon environmental exposure may change their sorbent properties. PMID:26281762

  3. The Holocene Records of Glycerol Dialkyl Glycerol Tetraethers From the Northern Chukchi Sea

    NASA Astrophysics Data System (ADS)

    Park, Y.; Yamamoto, M.; Nam, S.; Polyak, L. V.

    2013-12-01

    We analyzed glycerol dialkyl glycerol tetraethers (GDGTs) in Cores HOTRAX 05-01 JPC5 and JPC 8, and ARA02B 01-GC in the northern Chukchi Sea. All of the three cores showed a similar changing pattern in GDGT composition during the Holocene. In the beginning of early Holocene, both isoprenoid and branched GDGT concentrations were low, and BIT and CBT were relatively high. The similar composition is found in modern sediments from the western Arctic Ocean north of 75°N, suggesting that the northern Chukchi Sea was covered by perennial sea ice. GDGT concentration increased, and BIT and CBT decreased during the early Holocene and reached the same level as those in modern sediments at 8 ka. TEX86 and CBT/MBT indices showed millennial-scale variation. We interpret that these proxies did not simply indicate temperatures but were affected by the relative contribution of different sediment sources. Millennial-scale variability likely reflected changes in sediment transport in the northern Chukchi Sea.

  4. Application of N,N-dialkyl aliphatic amides in the separation of some actinides

    SciTech Connect

    Gasparini, G.M.; Grossi, G.

    1980-05-01

    N,N-dialkyl substituted alkyl amides are known to be good extractants of some actinides such as U, Pu, and Th. Their stability is comparable to that of TBP, and their degradation products do not interfere as do the degradation products of TBP. On the other hand, the principal disadvantage of the amides is their tendency to form poorly soluble U adducts in organic diluents. A systematic investigation has been carried out on the extractive behavior of two typical alkyl amides of different structures with respect to the actinide ions UO/sub 2/ /sup 2+/, Th /sup 4+/, Np /sup +4/, Pu /sup +4/, NpO /sub 2/ /sup 2+/, PuO /sub 2/ / sup 2+/, Pu /sup 3+/, and Am /sup 3+/, as well as with respect to the most significant fission products. The results obtained have been compared with those obtained using TBP in the same experimental conditions, verifying the applicability of amides in the separation of U from Th.

  5. Source, settling and degradation of branched glycerol dialkyl glycerol tetraethers in the marine water column

    NASA Astrophysics Data System (ADS)

    Yamamoto, Masanobu; Shimamoto, Akifumi; Fukuhara, Tatsuo; Tanaka, Yuichiro

    2016-10-01

    Branched glycerol dialkyl glycerol tetraethers (branched GDGTs) are commonly found in distal marine sediments. However, their presence in the water column, source and delivery process are not fully understood. In this study, we examined seasonal and depth variation in the flux of branched GDGTs in sinking particles and underlying sediment at 39°N, 147°E in the mid-latitude NW Pacific from November 1997 to August 1999. Branched GDGTs showed synchronous variation in their sinking flux at different depths, and the variation was similar to that of lithogenic material of eolian dust origin. Their degrees of cyclization and methylation were nearly constant and bear some resemblance to those of alkaline soils. This suggests that westerly winds transport branched GDGTs to the study site via the atmosphere from continental Asia. The sinking flux of branched GDGTs was higher in 1999 than in 1998, presumably reflecting changes in the migration path of Asian dust in response to the El Niño-Southern Oscillation. Synchronous variation in branched GDGT concentrations at different depths implies rapid vertical transport of branched GDGTs to deep water with a sinking velocity exceeding 260 m d-1. The sinking flux of the branched GDGTs decreased with increasing depth, but the rate of decrease was much smaller than those of other compounds. The preservation efficiency of branched GDGTs was 3.5-6.4% of surface inputs at the water-sediment interface, which is much higher than those of isoprenoid GDGTs (1.0-1.3%) and other compounds. The branched and isoprenoid tetraether (BIT) index values were extremely low (i.e. <0.0015) in comparison with any other studies so far. The BIT values in the surface sediment were five times higher than those in sinking particles, which is attributed to the preferential preservation of branched GDGTs in oxic environments.

  6. [Antiesterase activity and toxicity of O,O-dialkyl-S-ethoxycarbonylbromomethylthiophosphates].

    PubMed

    Makhaeva, G F; Iankovskaia, V L; Kovaleva, N V; Fetisov, V I; Malygin, V V; Torgasheva, N A; Khaskin, B A

    1999-01-01

    The interaction of potential pesticides, O,O-dialkyl S-ethoxycarbonylbromomethylthiophosphates (RO)2P(O)SCH(Br)COOC2H5 (R = Et, i-Pr, n-Pr, n-Bu, n-Am, or n-Hx) with the esterases of warm-blooded animals [acetylcholinesterase (ACE), butyryl cholinesterase (BCE), and carboxyl esterase (CE)] was studied. The acute toxicities of these compounds for mice were determined. All the compounds were non-hydrolyzable by CE and capable of irreversible inhibition of all these esterases with ki (M-1 min-1) of 1.2 x 10(5)-6 x 10(6), 2.0 x 10(6)-1.5 x 10(8), and 2.0 x 10(8), respectively. By using multiple regression analysis, we found that the steric factor plays a significant role in the inhibition of ACE, with the steric hindrances manifesting themselves even at the sorption stage. On the other hand, hydrophobic interactions predominate in the case of BCE, while steric properties of its substituents exert a markedly weaker effect and manifest themselves at the phosphorylation stage. We suggested the presence of an electrophilic region in the active site of ACE, which can interact with the ethoxycarbonyl group of the thiophosphates under study. The decrease in toxicities and the affinities to BCE and CE were found to correlate with an increase in the length of n-alkyl substituents of the compounds studied. This suggests that the unspecific esterases play a significant role as a buffer system in the exhibition of toxic effects by the thiophosphates under consideration.

  7. Water availability determines branched glycerol dialkyl glycerol tetraether distributions in soils of the Iberian Peninsula

    NASA Astrophysics Data System (ADS)

    Menges, J.; Huguet, C.; Alcañiz, J. M.; Fietz, S.; Sachse, D.; Rosell-Melé, A.

    2013-06-01

    The MBT/CBT has recently gained significant attention as a novel paleotemperature proxy. It is based on the distribution of branched glycerol dialkyl glycerol tetraethers (GDGTs) in soils. The CBT quantifies the degree of cyclisation and relates to soil pH. The MBT' quantifies the degree of methylation and relates to mean annual temperature and soil pH. Combining these two indices allows estimation of mean annual temperature (MAT). However other factors such as soil water availability or moisture conditions have been suggested to influence the MBT'. To assess the effect of moisture conditions on the MBT'/CBT a set of 23 Iberian Peninsula soil samples covering a temperature range from 10-18 °C and a wide range of soil moisture regimes (405 mm to 1455 mm mean annual precipitation per year), was analyzed. We find that CBT is significantly correlated to soil pH confirming it as a robust proxy. In contrast the MBT' index was not correlated to MAT and was weakly correlated to annual mean precipitation (MAP). Instead we found a significant correlation between MBT' and the Aridity Index (AI), a parameter related to water availability in soils. The AI can explain 70% of the residuals of MAT estimation and 50% of the actual variation of the MBT'. This suggests that in dry environments or under moisture shortage the degree of methylation of branched GDGTs is not controlled by temperature but rather by the degree of water available. Our results suggest that the MBT/CBT index is not applicable as a paleotemperature proxy in dry subhumid to hyperarid environments.

  8. In situ production of branched glycerol dialkyl glycerol tetraethers in a great basin hot spring (USA)

    PubMed Central

    Zhang, Chuanlun L.; Wang, Jinxiang; Dodsworth, Jeremy A.; Williams, Amanda J.; Zhu, Chun; Hinrichs, Kai-Uwe; Zheng, Fengfeng; Hedlund, Brian P.

    2013-01-01

    Branched glycerol dialkyl glycerol tetraethers (bGDGTs) are predominantly found in soils and peat bogs. In this study, we analyzed core (C)-bGDGTs after hydrolysis of polar fractions using liquid chromatography-atmospheric pressure chemical ionization-mass spectrometry and analyzed intact P-bGDGTs using total lipid extract (TLE) without hydrolysis by liquid chromatography-electrospray ionization-multiple stage mass spectrometry. Our results show multiple lines of evidence for the production of bGDGTs in sediments and cellulolytic enrichments in a hot spring (62–86°C) in the Great Basin (USA). First, in situ cellulolytic enrichment led to an increase in the relative abundance of hydrolysis-derived P-bGDGTs over their C-bGDGT counterparts. Second, the hydrolysis-derived P- and C-bGDGT profiles in the hot spring were different from those of the surrounding soil samples; in particular, a monoglycosidic bGDGT Ib containing 13,16-dimethyloctacosane and one cyclopentane moiety was detected in the TLE but it was undetectable in surrounding soil samples even after sample enrichments. Third, previously published 16S rRNA gene pyrotag analysis from the same lignocellulose samples demonstrated the enrichment of thermophiles, rather than mesophiles, and total bGDGT abundance in cellulolytic enrichments correlated with the relative abundance of 16S rRNA gene pyrotags from thermophilic bacteria in the phyla Bacteroidetes, Dictyoglomi, EM3, and OP9 (“Atribacteria”). These observations conclusively demonstrate the production of bGDGTs in this hot spring; however, the identity of organisms that produce bGDGTs in the geothermal environment remains unclear. PMID:23847605

  9. Archaeal and bacterial glycerol dialkyl glycerol tetraether lipids in hot springs of yellowstone national park.

    PubMed

    Schouten, Stefan; van der Meer, Marcel T J; Hopmans, Ellen C; Rijpstra, W Irene C; Reysenbach, Anna-Louise; Ward, David M; Sinninghe Damsté, Jaap S

    2007-10-01

    Glycerol dialkyl glycerol tetraethers (GDGTs) are core membrane lipids originally thought to be produced mainly by (hyper)thermophilic archaea. Environmental screening of low-temperature environments showed, however, the abundant presence of structurally diverse GDGTs from both bacterial and archaeal sources. In this study, we examined the occurrences and distribution of GDGTs in hot spring environments in Yellowstone National Park with high temperatures (47 to 83 degrees C) and mostly neutral to alkaline pHs. GDGTs with 0 to 4 cyclopentane moieties were dominant in all samples and are likely derived from both (hyper)thermophilic Crenarchaeota and Euryarchaeota. GDGTs with 4 to 8 cyclopentane moieties, likely derived from the crenarchaeotal order Sulfolobales and the euryarchaeotal order Thermoplasmatales, are usually present in much lower abundance, consistent with the relatively high pH values of the hot springs. The relative abundances of cyclopentane-containing GDGTs did not correlate with in situ temperature and pH, suggesting that other environmental and possibly genetic factors play a role as well. Crenarchaeol, a biomarker thought to be specific for nonthermophilic group I Crenarchaeota, was also found in most hot springs, though in relatively low concentrations, i.e., <5% of total GDGTs. Its abundance did not correlate with temperature, as has been reported previously. Instead, the cooccurrence of relatively abundant nonisoprenoid GDGTs thought to be derived from soil bacteria suggests a predominantly allochthonous source for crenarchaeol in these hot spring environments. Finally, the distribution of bacterial branched GDGTs suggests that they may be derived from the geothermally heated soils surrounding the hot springs.

  10. Estimation of the presence of unmetabolized dialkyl phthalates in untreated human urine by an on-line miniaturized reliable method.

    PubMed

    Jornet-Martínez, N; Antón-Soriano, C; Campíns-Falcó, P

    2015-11-01

    At present, human exposure to dialkyl phthalates is assessed through urinary measurement of their metabolites due mainly to contamination in their analysis by their ubiquitous presence. An on-line miniaturized method and the processing of the untreated urine samples have been the key factors for minimizing contamination and achieving unbiased results. Di(2-ethylhexyl) (DEHP), diethyl (DEP), dibutyl (DBP) and mono-ethylhexyl (MEHP) phthalates in urine samples have been included in the study; MEHP as metabolite of the main dialkyl phthalate such as DEHP. On-line in-tube solid-phase microextraction (IT-SPME)-capillary liquid chromatography (CapLC) with diode array detection (DAD) is employed. The detection limits (LODs) achieved in urine were between 0.5 and 1.5 μg/L. Eighteen urines were processed. DBP and DEHP were found in nine and five samples, respectively and DEP in three of them. MEHP was only detected in one of the eighteen samples analyzed.

  11. Hydrological conditions determine branched glycerol dialkyl glycerol tetraether distributions in soils of the Iberian Peninsula

    NASA Astrophysics Data System (ADS)

    Huguet, Carme; Menges, Johanna; Fietz, Susanne; Sachse, Dirk; Rosell-Melé, Antoni

    2013-04-01

    Temperature is one of the key environmental factors driving climate change, but past continental temperature records are constrained by the few proxies that can be applied in these environments. The MBT-CBT proxy is based on the distribution of branched glycerol dialkyl glycerol tetraethers (brGDGTs), bacterial membrane lipids in soils1.Since the degree of cyclisation of the GDGTs (CBT) was found to corellate to soil pH, while tindex degree of methylation (MBT) corellates to mean annual temperature and soil pH. a combination of these two indices allows the estimation of mean annual temperature (MAT). However, it has been suggested, that other factors such as the hydrological conditions can also influence the MBT2, although it has never been testet directly. To asses the effect of hydrological conditions on the MBT-CBT a set of 25 soil samples of the Iberian Peninsula covering a temperature range from 10-18°C and a wide range of hydrological regimes was analysed (405 mm to 1455 mm per year) . We found that CBT was significantly correlated to soil pH confirming it even at a regional scale as a robust proxy for soil pH. The MBT was also shown to relate to soil pH, but the the expected relation between MBT and MAT could not be established. In fact, the correlation between MBT and MAT was inverse to the one expected according to previous studies and presented large scatter (R2=0,2). Consequently the MAT estimation using the MBT-CBT proxy leads to an underestimation of MAT, which is most prominent at the dryest sites and reaches up to 24°C. Instead we found a significant correlation between MBT and annual mean precipitation as well as the Aridity Index (AI)3, a parameter quantifying water availability in soils. This suggests that in dry environments or under moisture shortage the influence of the degree of methylation of branched GDGTs is not coupled to temperature but to the degree of water availability. 1. Weijers, J.W.H. et al. 2007. GCA. 71, 703-713. 2. Peterse, F

  12. Plio-Pleistocene Temperature Variability in the Terrestrial Arctic: Insights from Branched Glycerol Dialkyl Glycerol Tetraethers

    NASA Astrophysics Data System (ADS)

    Castañeda, I. S.; Salacup, J.; de Wet, G.; Habicht, M. H.; Keisling, B. A.; Phu, V.; Johnson, J.; Lukas, S.; Lyons, N.; Brigham-Grette, J.

    2014-12-01

    Drill coring at Lake El'gygytgyn (Far East Russia) in 2009 retrieved a 3.6 Ma long sediment core, which is presently the oldest continuous sedimentary record available from the terrestrial Arctic. This unique Plio-Pleistocene record allows for the response of the Arctic to global climate events under a variety of different boundary conditions to be examined. Here we present results of ongoing organic geochemical analyses of Lake El'gygytgyn sediments focusing on the mid-Pliocene warm period, the Plio-Pleistocene transition, the mid-Brunhes transition, and warm Pleistocene interglacial periods including Marine Isotope Stages (MIS) 5, 9, 11, 19 and 31. Despite the ultra-oligotrophic nature of Lake El'gygytgyn and the generally low sedimentary total organic carbon (TOC) content, we find abundant branched glycerol dialkyl glycerol tetraethers (brGDGTs) throughout the entire record and use the methylation and cyclization indices of branched tetraethers (MBT and CBT, respectively) to reconstruct past temperature (Weijers et al., 2007). We hypothesize that the majority of brGDGTs are produced in the lake during the brief summer period of ice free conditions and that MBT/CBT likely reflects a warm season temperature. Trends noted in the MBT/CBT record are in close agreement with pollen-based temperature estimates throughout the entire core. For example, we note a dramatic ~6°C cooling associated with the mid-Pliocene M2 event and thus far MIS 31 has emerged as the warmest period at Lake El'gygytgyn during the past ~ 1 Ma, corroborating the pollen data. Interestingly, a number of abrupt and relatively short-lived cooling events of 2 to 4°C are noted within several of the particularly warm interglacial periods (e.g. MIS 5e, MIS 11 and MIS 31) and are the subject of ongoing investigation. Overall, application of the MBT/CBT paleothermometer to Lake El'gygytgyn sediments is a highly promising technique for generating a Plio-Pleistocene temperature record from the continental

  13. Cycloaddition reactions of allenylphosphonates and related allenes with dialkyl acetylenedicarboxylates, 1,3-diphenylisobenzofuran, and anthracene.

    PubMed

    Sajna, K V; Kotikalapudi, Ramesh; Chakravarty, Manab; Bhuvan Kumar, N N; Swamy, K C Kumara

    2011-02-01

    Cycloaddition reactions of allenylphosphonates [(RO)(2)P(O)[(R(1))C═C═CR(2)(2)] with dialkyl acetylenedicarboxylates, 1,3-diphenylisobenzofuran, and anthracene have been investigated and compared with those of allenoates [(EtO(2)C)RC═C═CH(2)] and allenylphosphine oxides [Ph(2)P(O)(R(1))C═C═CR(2)(2)] in selected cases. Allenylphosphonates (RO)(2)P(O)(Ar)C═C═CH(2) with an α-aryl group preferentially undergo [4 + 2] cycloaddition with DMAD/DEAD under thermal activation, but in addition to the expected 1:1 (allene: DMAD) product, the reaction also leads to 1:2 as well as 2:1 products that were not reported before. When an extra vinyl group is present at the γ-carbon of allenylphosphonate [e.g., (OCH(2)CMe(2)CH(2)O)P(O)(Ph)C═C═CH(C═CHMe)], [4 + 2] cycloaddition takes place utilizing either the vinylic or the aryl end, but additionally a novel cyclization wherein complete opening of the [β,γ] carbon-carbon double bond of the allene is realized. In contrast to these, the reaction of allenylphosphonate (OCH(2)CMe(2)CH(2)O)P(O)(H)C═C═CMe(2) possessing a terminal ═CMe(2) group with DMAD occurs by both [2 + 2] cycloaddition and ene reaction. While the reaction of ═CH(2) terminal allenylphosphonates as well as allenylphosphine oxides with 1,3-diphenylisobenzofuran afforded preferentially endo-[4 + 2] cycloaddition products via [α,β] attack, the analogous allenoates [(EtO(2)C)RC═C═CH(2)] underwent exo-[4 + 2] cyclization. Under similar conditions, allenylphosphonates with a terminal ═CR(2) group gave only [β,γ]-cycloaddition products. An unusual ring-opening of a [4 + 2] cycloaddition product followed by ring-closing via [4 + 4] cycloaddition, as revealed by (31)P NMR spectroscopy, is reported. Anthracene reacted in a manner similar to 1,3-diphenylisobenzofuran, albeit with lower reactivity. Key products, including a set of exo- and endo- [4 + 2] cycloaddition products, have been characterized by single crystal X-ray crystallography.

  14. Inverse-Micelle-Encapsulated Water-Enabled Bond Breaking of Dialkyl Diselenide/Disulfide: A Critical Step for Synthesizing High- Quality Gold Nanoparticles

    SciTech Connect

    Zaluzhna, Oksana; Li, Ying; Allison, Thomas C.; Tong, Yu ye J.

    2012-10-09

    Inverse-micelle-encapsulated water formed in the two-phase Brust-Schiffrin method (BSM) synthesis of Au nanoparticles (NPs) is identified as essential for dialkyl diselenide/disulfide to react with the Au(III) complex in which the Se-Se/S-S bond is broken, leading to formation of higher-quality Au NPs.

  15. Glycerol dialkyl glycerol tetraethers preserved in stalagmites: a new continental palaeothermometer

    NASA Astrophysics Data System (ADS)

    Blyth, A. J.; Schouten, S.

    2010-12-01

    The ability to recover reliable temperature records is central to palaeoclimatic research, informing our understanding of the past and our models of the future. However, there is a need for new quantitative terrestrial temperature proxies. Here we present a novel palaeothermometer, combining molecular temperature proxies with the strong dating control and established environmental records provided by stalagmites. The results show good correlations between known and calculated temperatures, suggesting that the approach has considerable potential as a climatic proxy. Glycerol dialkyl glycerol tetraethers (GDGTs) are microbial membrane lipids, which vary in structure with temperature and pH [1]. In the terrestrial realm, the focus is on bacterially derived GDGTs, which have been used to measure terrestrial organic matter input to aquatic deposits via the BIT index [2], and developed into a temperature related index (MBT/CBT) in soils and near-shore marine sediments (MBT/CBT), based upon the degree of branching and cyclicisation of the carbon skeleton [3]. Stalagmites form an ideal archive for terrestrial climate records, as they are stable, can be easily dated, and contain a number of environmental proxies (stable isotopes, trace elements, organic matter etc). Attempts have been made to develop inorganic temperature proxies in stalagmites, most recently using isotopic analysis of fluid inclusions. However, the use of organic temperature proxies in this context is largely unstudied. Thirty-eight stalagmite or stalactite samples from twenty-one sites around the world were analysed for their GDGT content. Calcite samples were cleaned and decalcified with HCl, and lipids extracted into dichloromethane via liquid-liquid extraction. Each extract was then prepared and analysed via HPLC-MS following Weijers et al. [3]. The results show low but usable levels of GDGTs in all but one sample. Peak size measurements were made for all recognised compounds associated with BIT and

  16. Chemistry Notes.

    ERIC Educational Resources Information Center

    School Science Review, 1983

    1983-01-01

    Presents background information, laboratory procedures, classroom materials/activities, and chemistry experiments. Topics include sublimation, electronegativity, electrolysis, experimental aspects of strontianite, halide test, evaluation of present and future computer programs in chemistry, formula building, care of glass/saturated calomel…

  17. Chemistry Notes

    ERIC Educational Resources Information Center

    School Science Review, 1972

    1972-01-01

    Thirteen ideas are presented that may be of use to chemistry teachers. Topics covered include vitamin C, industrial chemistry, electrical conductivity, electrolysis, alkali metals, vibration modes infra-red, dynamic equilibrium, and some new demonstrations in gaseous combinations. (PS)

  18. Chemistry Notes.

    ERIC Educational Resources Information Center

    School Science Review, 1978

    1978-01-01

    Describes experiments, demonstrations, activities and ideas relating to various fields of chemistry to be used in chemistry courses of secondary schools. Three experiments concerning differential thermal analysis are among these notes presented. (HM)

  19. Chemistry Notes

    ERIC Educational Resources Information Center

    School Science Review, 1976

    1976-01-01

    Described are eight chemistry experiments and demonstrations applicable to introductory chemistry courses. Activities include: measure of lattice enthalpy, Le Chatelier's principle, decarboxylation of soap, use of pocket calculators in pH measurement, and making nylon. (SL)

  20. Colour Chemistry

    ERIC Educational Resources Information Center

    Griffiths, J.; Rattee, I. D.

    1973-01-01

    Discusses the course offerings in pure color chemistry at two universities and the three main aspects of study: dyestuff chemistry, color measurement, and color application. Indicates that there exists a constant challenge to ingenuity in the subject discipline. (CC)

  1. Chemistry Notes.

    ERIC Educational Resources Information Center

    School Science Review, 1982

    1982-01-01

    Presents background information, laboratory procedures, classroom materials/activities, and experiments for chemistry. Topics include superheavy elements, polarizing power and chemistry of alkali metals, particulate carbon from combustion, tips for the chemistry laboratory, interesting/colorful experiments, behavior of bismuth (III) iodine, and…

  2. CLUSTER CHEMISTRY

    SciTech Connect

    Muetterties, Earl L.

    1980-05-01

    Metal cluster chemistry is one of the most rapidly developing areas of inorganic and organometallic chemistry. Prior to 1960 only a few metal clusters were well characterized. However, shortly after the early development of boron cluster chemistry, the field of metal cluster chemistry began to grow at a very rapid rate and a structural and a qualitative theoretical understanding of clusters came quickly. Analyzed here is the chemistry and the general significance of clusters with particular emphasis on the cluster research within my group. The importance of coordinately unsaturated, very reactive metal clusters is the major subject of discussion.

  3. Forensic Chemistry

    NASA Astrophysics Data System (ADS)

    Bell, Suzanne

    2009-07-01

    Forensic chemistry is unique among chemical sciences in that its research, practice, and presentation must meet the needs of both the scientific and the legal communities. As such, forensic chemistry research is applied and derivative by nature and design, and it emphasizes metrology (the science of measurement) and validation. Forensic chemistry has moved away from its analytical roots and is incorporating a broader spectrum of chemical sciences. Existing forensic practices are being revisited as the purview of forensic chemistry extends outward from drug analysis and toxicology into such diverse areas as combustion chemistry, materials science, and pattern evidence.

  4. Methylation and cyclisation of branched glycerol dialkyl glycerol tetraethers as temperature and pH proxies

    NASA Astrophysics Data System (ADS)

    Blaga, C. I.; Reichart, G.-J.; Schouten, S.; Lotter, A.; Sinninghe Damste, J. S.

    2009-04-01

    Branched glycerol dialkyl glycerol tetraethers (GDGTs) containing 0 to 2 cyclopentyl moieties were initially detected in peat deposits [1]. Through the analysis of a global set of soils samples Weijers et al. [2] showed that these GDGTs, probably of bacterial origin, are produced in situ in these soils. Rivers and direct run-off transport these compounds, together with other soil organic matter, to marine [3] and lake sediments [4, 5]. Recently, Weijers et al. [6] defined two indices that are based on branched GDGTs that are distinctively influenced by two environmental factors. The cyclisation ratio of the branched tetraethers (CBT) is related to soil pH and the methylation index of branched tetraethers (MBT) is related to temperature and soil pH. Lake sediments are often used for reconstructing past climatic changes. The presence of branched GDGTs in lake sediments potentially allows reconstruction of temperature and pH of the lake drainage area. We performed organic geochemical analyses on a series of surface sediments from 82 lakes characterised by variable amounts of soil organic matter and from different geographical locations to establish the application of the MBT/CBT as a continental palaeothermometer. Results show that in all of the 82 lakes substantial amounts of branched GDGTs are present (0.1-28% of total GDGTs). Besides the branched GDGTs crenarchaeol was also found in appreciable amounts (on average 23% of the total GDGTs). In the lakes from the northern hemisphere in fact the dominant GDGT is crenarchaeol (38% of total GDGTs) followed by the pentamethylated branched GDGT. In the southern hemisphere on the other hand we observe the hexamethylated branched GDGT as the dominant GDGT and crenarchaeol is here ten times less abundant then in the north (on average 3% of total GDGTs only). The CBT, as defined by Weijers et al. [6], for the entire data set ranges from values close to 0 (0.14 for Lake Ohrid) to 1.7 (Lake Nyos). The MBT ratio, also as defined

  5. Determination of alkyl benzyl and dialkyl dimethyl quaternary ammonium biocides in occupational hygiene and environmental media by liquid chromatography with electrospray ionisation mass spectrometry and tandem mass spectrometry.

    PubMed

    Ford, Michael J; Tetler, Lee W; White, John; Rimmer, Duncan

    2002-04-01

    A new method for the simultaneous qualitative and quantitative determination of alkyl benzyl and dialkyl quaternary ammonium compounds (QACs) has been developed. Analysis is by reversed-phase high-performance liquid chromatography coupled with electrospray ionisation mass spectrometry. QACs are extremely amenable to the electrospray ionisation technique (limit of detection of BAC C12 homologue 3 ng ml(-1)). The selectivity of mass spectrometric detection allows simultaneous determination of benzyl and dialkyl dimethyl ammonium compounds. The method was successfully applied to the analysis of real samples (occupational hygiene sampling devices, products and swimming pool water). Structural information was obtained by MS-MS and cone voltage ion dissociation techniques. Ion dissociation enabled the structural elucidation of an unknown quaternary ammonium compound present in a commercial formulation.

  6. An improved AMBER force field for α,α-dialkylated peptides: intrinsic and solvent-induced conformational preferences of model systems.

    PubMed

    Grubišić, Sonja; Brancato, Giuseppe; Barone, Vincenzo

    2013-10-28

    α,α-Dialkylated amino acid residues have acquired considerable importance as effective means for introducing backbone conformation constraints in synthetic peptides. The prototype of such a class of residues, namely Aib (α-aminoisobutyric acid), appears to play a dominant role in determining the preferred conformations of host proteins. We have recently introduced into the standard AMBER force field some new parameters, fitted against high-level quantum mechanical (QM) data, for simulating peptides containing α,α-dialkylated residues with cyclic side chains, such as TOAC (TOAC, 2,2,6,6-tetramethylpiperidine-1-oxyl-4-amino-4-carboxylic acid) and Ac6c (Ac6c = 1-aminocyclohexaneacetic acid). Here, we show that in order to accurately reproduce the observed conformational geometries and structural fluctuations of linear α,α-dialkylated peptides based on Aib, further improvements of the non-bonding and side chain torsion potential parameters have to be considered, due to the expected larger structural flexibility of linear residues with respect to cyclic ones. To this end, we present an extended set of parameters, which have been optimized by fitting the energies of multiple conformations of the Aib dipeptide analogue to corresponding QM calculations that properly account for dispersion interactions (B3LYP-D3). The quality, transferability and size-consistency of the proposed force field have been assessed both by considering a series of poly-Aib peptides, modeled at the same QM level, and by performing molecular dynamics simulations in solvents with high and low polarity. As a result, the present parameters allow one to reproduce with good reliability the available QM and experimental data, thus representing a notable improvement over current force field especially in the description of the α/310-helix conformational equilibria of α,α-dialkylated peptides with linear and cyclic side chains.

  7. Urinary Dialkyl Phosphate Concentrations and Lung Function Parameters in Adolescents and Adults: Results from the Canadian Health Measures Survey

    PubMed Central

    Ye, Ming; Beach, Jeremy; Martin, Jonathan W.; Senthilselvan, Ambikaipakan

    2015-01-01

    Background: Epidemiological studies have reported associations between lung function parameters and organophosphate (OP) pesticide exposures in agricultural occupations, but to our knowledge associations have not been evaluated in general populations. Objectives: We examined associations between OP metabolite dialkyl phosphates (DAPs) and lung function using data from the Canadian Health Measures Survey (CHMS) Cycle 1. Methods: Forced vital capacity (FVC), forced expiratory volume in 1 sec (FEV1), FEV1/FVC ratio, and forced expiratory flow between 25% and 75% of FVC (FEF25%–75%) were measured for 4,446 CHMS participants. Urinary concentrations of six DAP metabolites (DMP, DMTP, DMDTP, DEP, DETP, and DEDTP), smoking status, and other predictors of lung function were also measured in the CHMS-Cycle 1. Multiple linear regression analyses were used to examine the relationship between total DAP concentrations (ΣDAPs) and lung function in adolescents (12–19 years) and adults (20–79 years). Results: In adults, estimates from multiple regression analyses suggested that a 1-unit increase on natural logarithmic scale (171% increase on the original scale) in the creatinine-corrected urinary concentration (nanomoles per gram creatinine) of ΣDAP was associated with a 32.6-mL (95% CI: –57.2, –8.1) reduction in FVC, 32.6-mL (95% CI: –59.0, –6.3) reduction in FEV1, 0.2% (95% CI: –0.6, 0.2) reduction in FEV1/FVC ratio, and 53.1-mL/sec (95% CI: –113.9, 7.7) reduction in FEF25%–75%. In adolescents, associations between ΣDAP and FEV1 were closer to the null and positive for FVC, whereas associations with FEV1/FVC and FEF25%–75% were negative, as in adults. However, none of the associations were significant in adolescents. Conclusions: The negative association between ΣDAP and lung function in adult participants suggests a detrimental effect of OP pesticides on lung function in the adult general population. Further studies using prospective designs are

  8. Chemistry Notes

    ERIC Educational Resources Information Center

    School Science Review, 1972

    1972-01-01

    Twelve new chemistry expermiments are described. Broad areas covered include atomic structure, solubility, gaseous diffusion, endothermic reactions, alcohols, equilibrium, atomic volumes, and some improvised apparatus. (PS)

  9. Chemistry Notes.

    ERIC Educational Resources Information Center

    School Science Review, 1981

    1981-01-01

    Outlines laboratory procedures, demonstrations, teaching suggestions, and content information related to chemistry. Topics include polarizing power; calorimetry and momentum; microcomputers in school chemistry; a constant-volume dispenser for liquids, floating magnets, and crystal lattices; preparation of chromium; and solvent polarity and…

  10. Preparation and tribological properties of inclusion complex of β-cyclodextrin/dialkyl pentasulfide as additive in PEG-600 aqueous solution

    NASA Astrophysics Data System (ADS)

    Guan, Jiju; Xu, Xuefeng; Li, Gan; Peng, Wei

    2014-01-01

    The inclusion complex of β-cyclodextrin (β-CD) and dialkyl pentasulfide (DPS), in which DPS was incorporated into β-CD cavities, was prepared by a co-precipitation method. The tribological properties of the complex used as lubricant additive in PEG 600 aqueous solution were investigated by a four-ball tester. The complex exhibited better tribological properties than β-CD under different loads, and also showed better anti-friction performance than DPS in the latter half of the test duration. The tribological action mechanism of the complex on a steel surface was studied according to the X-ray photoelectron spectroscopy (XPS) analyses. The β-CD molecules of the complexes were decomposed into various molecular fragments and the DPS molecules were released under the friction condition. It revealed that thiolate and ferrous sulfide (FeS) films formed by DPS played a major role, and iron alkoxide and carbon deposition films formed by the friction fragments of β-CD mainly exhibited anti-friction property on FeS-to-FeS interface. The interactions among different films led to the formation of a mixed boundary lubrication film.

  11. Circumstellar chemistry

    NASA Technical Reports Server (NTRS)

    Glassgold, Alfred E.; Huggins, Patrick J.

    1987-01-01

    The study of the outer envelopes of cool evolved stars has become an active area of research. The physical properties of CS envelopes are presented. Observations of many wavelengths bands are relevant. A summary of observations and a discussion of theoretical considerations concerning the chemistry are summarized. Recent theoretical considerations show that the thermal equilibrium model is of limited use for understanding the chemistry of the outer CS envelopes. The theoretical modeling of the chemistry of CS envelopes provides a quantitive test of chemical concepts which have a broader interest than the envelopes themselves.

  12. Chemistry Notes

    ERIC Educational Resources Information Center

    School Science Review, 1973

    1973-01-01

    Several ideas are proposed for chemistry teachers to try in their classrooms. Subjects included are polymerization of acrylate, polymerization of styrene, conductivity, pollution, preparation of chlorine, redox equations, chemiluminescence, and molecular sieves. (PS)

  13. Chemistry Notes.

    ERIC Educational Resources Information Center

    School Science Review, 1981

    1981-01-01

    Describes 13 activities, experiments and demonstrations, including the preparation of iron (III) chloride, simple alpha-helix model, investigating camping gas, redox reactions of some organic compounds, a liquid crystal thermometer, and the oxidation number concept in organic chemistry. (JN)

  14. Nuclear Chemistry.

    ERIC Educational Resources Information Center

    Chemical and Engineering News, 1979

    1979-01-01

    Provides a brief review of the latest developments in nuclear chemistry. Nuclear research today is directed toward increased activity in radiopharmaceuticals and formation of new isotopes by high-energy, heavy-ion collisions. (Author/BB)

  15. Precolumbian Chemistry.

    ERIC Educational Resources Information Center

    Robinson, Janet Bond

    1995-01-01

    Describes the content and development of a curriculum that provides an approach to descriptive chemistry and the history of technology through consideration of the pottery, metallurgy, pigments, dyes, agriculture, and medicine of pre-Columbian people. (DDR)

  16. Catalytic Chemistry.

    ERIC Educational Resources Information Center

    Borer, Londa; And Others

    1996-01-01

    Describes an approach for making chemistry relevant to everyday life. Involves the study of kinetics using the decomposition of hydrogen peroxide by vegetable juices. Allows students to design and carry out experiments and then draw conclusions from their results. (JRH)

  17. Chemistry Notes.

    ERIC Educational Resources Information Center

    School Science Review, 1980

    1980-01-01

    Describes equipment, activities, and experiments useful in chemistry instruction, including among others, a rapid method to determine available chlorine in bleach, simple flame testing apparatus, and a simple apparatus demonstrating the technique of flash photolysis. (SK)

  18. Stratospheric chemistry

    SciTech Connect

    Brune, W.H. )

    1991-01-01

    Advances in stratospheric chemistry made by investigators in the United States from 1987 to 1990 are reviewed. Subject areas under consideration include photochemistry of the polar stratosphere, photochemistry of the global stratosphere, and assessments of inadvertent modification of the stratosphere by anthropogenic activity. Particular attention is given to early observations and theories, gas phase chemistry, Antarctic observations, Arctic observations, odd-oxygen, odd-hydrogen, odd-nitrogen, halogens, aerosols, modeling of stratospheric ozone, and reactive nitrogen effects.

  19. Evidence of moisture control on the methylation of branched glycerol dialkyl glycerol tetraethers in semi-arid and arid soils

    NASA Astrophysics Data System (ADS)

    Dang, Xinyue; Yang, Huan; Naafs, B. David A.; Pancost, Richard D.; Xie, Shucheng

    2016-09-01

    The distribution of bacterial branched glycerol dialkyl glycerol tetraethers (brGDGTs) is influenced by growth temperature and pH. This results in the widespread application of the brGDGT-based MBT(‧)/CBT proxy (MBT - methylation of branched tetraethers, CBT - cyclization of branched tetraethers) in terrestrial paleo-environmental reconstructions. Recently, it was shown that the amount of precipitation could also have an impact on CBT, as well as the abundance of brGDGTs relative to that of archaeal isoprenoidal (iso)GDGTs (Ri/b) and the absolute abundance of brGDGTs, potentially complicating the use of MBT/CBT as paleothermometer. However, the full influence of hydrology, and in particular soil water content (SWC), on GDGT distributions remains unclear. Here we investigated variations in the GDGT distribution across a SWC gradient (0-61%) around Qinghai Lake in the Tibetan Plateau, an arid to semiarid region in China. Our results demonstrate that SWC affects the brGDGT distribution. In particular, we show that SWC has a clear impact on the degree of methylation of C6-methylated brGDGTs, whereas C5-methylated brGDGTs are more impacted by temperature. This results in a combined SWC and temperature control on MBT‧. In this context we propose a diagnostic parameter, the IR6ME (relative abundance of C6-methylated GDGTs) index, to evaluate the applicability of brGDGT-based paleotemperature reconstructions. Using the global dataset, expanded with our own data, MBT‧ has a significant correlation with mean annual air temperature when IR6ME < 0.5, allowing for the use of MBT‧/CBT as temperature proxy. However, MBT‧ has a significant correlation with mean annual precipitation (i.e., a substantial reflection of SWC impact) when IR6ME > 0.5, implying that MBT‧ may respond to hydrological change in these regions and can be used as a proxy for MAP.

  20. Iodobismuthates with N-alkyl- or N,N'-dialkyl-4,4'-bipyridinium: syntheses, structures and dielectric properties.

    PubMed

    Chen, Yang; Yang, Zhou; Wu, Xin-Yi; Ni, Chun-Yan; Ren, Zhi-Gang; Wang, Hui-Fang; Lang, Jian-Ping

    2011-04-01

    The solvothermal reactions of BiI(3), KI, I(2), 4,4'-bipyridine (4,4'-bipy), and a small amount of water in alcohol and acetonitrile produced four bipyridinium iodobismuthates {[MQ](3)[Bi(2)I(6)(μ-I)(3)][Bi(2)I(6)(μ-I)(2)(MQ)(2)](3)} (1, MQ(+) = N-methyl-4,4'-bipyridinium), {[EQ](3)[Bi(2)I(6)(μ-I)(3)][Bi(2)I(6)(μ-I)(2)(EQ)(2)](3)} (2, EQ(+) = N-ethyl-4,4'-bipyridinium), [MV][BiI(5)] (Eur. J. Inorg. Chem., 2010, 5326) (3, MV(2+) = N,N'-dimethyl-4,4'-bipyridinium), and [EV](2)[Bi(4)I(10)(μ-I)(4)(μ(3)-I)(2)] (4, EV(2+) = N,N'-diethyl-4,4'-bipyridinium). In these reactions, 4,4'-bipy was partly or completely alkylated by alkyl groups generated from the cleavage of C-O bond of alcohols, forming the N-alkyl-4,4'-bipyridinium cation (Q(+)) and the N,N'-dialkyl-4,4'-bipyridinium dication (V(2+)), respectively. Compounds 1-4 were characterized by elemental analysis, IR, (1)H NMR and single-crystal X-ray diffraction analysis. The optical, electrical conductive and dielectric properties of these compounds were investigated. The dielectric constants of the Q(+)-based compounds were larger than the values of the V(2+)-based ones, which showed that the weak electrostatic interactions in the structures may benefit the polarizability of molecules, thereby resulting in a larger dielectric response of the structures under an external electric field, while the strong electrostatic interactions between the positive and negative charge units would lead to a low dielectric constant (low-k) behavior of these compounds.

  1. Determinants of urinary concentrations of dialkyl phosphates among pregnant women in Canada - Results from the MIREC study.

    PubMed

    Sokoloff, Katia; Fraser, William; Arbuckle, Tye E; Fisher, Mandy; Gaudreau, Eric; LeBlanc, Alain; Morisset, Anne-Sophie; Bouchard, Maryse F

    2016-09-01

    Organophosphate (OP) insecticides are commonly used in agriculture. Their use decreased in recent years as they were gradually replaced by other pesticides, but some OPs are still among the insecticides most used in Canada. Exposure to elevated levels of OPs during pregnancy has been associated with adverse birth outcomes and poorer neurodevelopment in children. The objective of the present study was to examine the relationship between the concentrations of OP pesticides urinary dialkyl phosphate (DAP) metabolites and various factors that are potential sources of exposure or determinants of DAP levels. In the Maternal-Infant Research on Environmental Chemicals (MIREC) Study, six DAPs were measured in 1st trimester urine samples of 1884 pregnant women living in Canada. They were grouped into sums of dimethyl alkyl phosphates (DMAP) and diethyl alkyl phosphates (DEAP) for statistical analysis. We found that 93% of women had at least one DAP detected in their urine. Geometric means (GM) of specific gravity-corrected levels for urine dilution were 59 (95% CI 56-62) and 21 (95% CI 20-22) nmol/L for DMAP and DEAP, respectively. The following characteristics were significantly associated with higher urinary concentrations of DMAP or DEAP: higher education, nulliparous, normal pre-pregnancy body mass index, non-smoker, not fasting at sampling, winter season at sampling, and early and late day collection times. Dietary items that were significantly related with higher urinary concentrations included higher intake of citrus fruits, apple juice, sweet peppers, tomatoes, beans and dry peas, soy and rice beverages, whole grain bread, white wine and green and herbal teas. This study indicates that exposure to these compounds is quasi-ubiquitous. The factors associated with greater DAP levels identified here could be useful to regulatory agencies for risk analysis and management. However, some exposure misclassification might occur due to the single DAP measurement available, and

  2. Influence of water availability in the distributions of branched glycerol dialkyl glycerol tetraether in soils of the Iberian Peninsula

    NASA Astrophysics Data System (ADS)

    Menges, J.; Huguet, C.; Alcañiz, J. M.; Fietz, S.; Sachse, D.; Rosell-Melé, A.

    2014-05-01

    The combined application of the MBT (degree of methylation) and CBT (degree of cyclization) indices, based on the distribution of branched glycerol dialkyl glycerol tetraethers (brGDGTs) in soils, has been proposed as a paleoproxy to estimate mean annual temperature (MAT). CBT quantifies the degree of cyclization of brGDGTs and relates to soil pH. MBT and the simplified version MBT' quantify the degree of methylation of brGDGTs and relate to MAT and soil pH. However, other factors such as soil water availability have also been suggested to influence MBT' and possibly restrict the combined application of the MBT' and CBT indices as a paleotemperature proxy. To assess the effect of hydrological conditions on MBT' and CBT, a set of 23 Iberian Peninsula soil samples, covering a MAT range from 10 to 18 °C and a mean annual precipitation (MAP) range of 405 mm to 1455 mm, was analyzed. We found that the CBT was indeed significantly correlated with soil pH in our sample set. In contrast, MBT' was not correlated with MAT but had a significant correlation with the aridity index (AI), a parameter related to water availability in soils. The AI can explain 50% of the variation of the MBT', and 70% of the residuals of MAT estimated with the MBT/CBT proxy as compared to instrumentally measured MAT. We propose that, in arid settings, where water may be an ecologically limiting factor, MBT' is influenced by hydrological conditions rather than temperature. Thus, our results suggest that the combination of MBT' and CBT indices should be applied with caution in paleotemperature reconstructions in soils from dry subhumid to hyperarid environments.

  3. Branched glycerol dialkyl glycerol tetraethers in Arctic lake sediments: Sources and implications for paleothermometry at high latitudes

    NASA Astrophysics Data System (ADS)

    Peterse, Francien; Vonk, Jorien E.; Holmes, R. Max; Giosan, Liviu; Zimov, Nikita; Eglinton, Timothy I.

    2014-08-01

    Branched glycerol dialkyl glycerol tetraethers (brGDGTs) are analyzed in different lakes of the Mackenzie (Canadian Arctic) and Kolyma (Siberian Arctic) River basins to evaluate their sources and the implications for brGDGT-based paleothermometry in high-latitude lakes. The comparison of brGDGT distributions and concentrations in the lakes with those in river suspended particulate matter, riverbank sediments, and permafrost material indicates that brGDGTs in Arctic lake sediments have mixed sources. In contrast to global observations, distributional offsets between brGDGTs in Arctic lakes and elsewhere in the catchment are minor, likely due to the extreme seasonality and short window of biological production at high latitudes. Consequently, both soil- and lake-calibrated brGDGT-based temperature proxies return sensible temperature estimates, even though the mean air temperature (MAT) in the Arctic is below the calibration range. The original soil-calibrated MBT-CBT (methylation of branched tetraethers-cyclisation of branched tetraethers) proxy generates MATs similar to those in the studied river basins, whereas using the recently revised MBT'-CBT calibration overestimates MAT. The application of the two global lake calibrations, generating summer air temperatures (SAT) and MAT, respectively, illustrates the influence of seasonality on the production of brGDGTs in lakes, as the latter overestimates actual MAT, whereas the SAT-based lake calibration accounts for this influence and consequently returns more accurate temperatures. Our results in principle support the application of brGDGT-based temperature proxies in high-latitude lakes in order to obtain long-term paleotemperature records for the Arctic, although the calibration and associated transfer function have to be selected with care.

  4. Distribution of Glycerol Dialkyl Glycerol Tetraethers in Soils from Two Environmental Transects in the U.S

    NASA Astrophysics Data System (ADS)

    Dirghangi, S. S.; Pagani, M.; Hren, M. T.; Tipple, B. J.

    2012-12-01

    Glycerol Dialkyl Glycerol Tetraethers (GDGT) of both archaeal and bacterial origins form the basis of new temperature proxies applicable to soils, lake and marine sediments. In soils, branched GDGTs are prevalent and the abundance of methyl or cyclic groups in these compounds has been calibrated to mean-annual temperatures using MBT and CBT indices. However, soil pH is also known to be an important variable controlling the distribution of branched GDGTs. The factors influencing soil pH include bedrock type, vegetation, soil microbial activity, precipitation amount, drainage etc. For this study, we evaluate the distribution of branched GDGTs from two soil transects in the United States: a dry, western transect that covers four western states, and a wet, east-coast transect from Maine to Georgia in order to assess the effect of precipitation on the distribution of soil GDGTs. Our results show distinctly different GDGT distributions across climatic regions, with dry western soils predominantly characterized by crenarchaeal isoprenoidal GDGTs and moist-temperate east-coast transect soils expressing mostly branched GDGTs. Predominance of isoprenoidal GDGTs in the western soils is related to the degree of aeration which in turn is related to precipitation amount. We also observe a substantial increase in the offset between measured mean-annual temperatures (MAT) and MBT/CBT-based MAT below an annual precipitation of 700-800mm per year. These data suggest that while soil tetraethers work well as a temperature proxy in moist-temperate regimes, they do not produce reliable measurements of temperature in sediments sourced from areas with less than 700-800mm per year precipitation.

  5. Concentrations and abundance ratios of long-chain alkenones and glycerol dialkyl glycerol tetraethers in sinking particles south of Java

    NASA Astrophysics Data System (ADS)

    Chen, Wenwen; Mohtadi, Mahyar; Schefuß, Enno; Mollenhauer, Gesine

    2016-06-01

    In this study, we obtained concentrations and abundance ratios of long-chain alkenones and glycerol dialkyl glycerol tetraethers (GDGTs) in a one-year time-series of sinking particles collected with a sediment trap moored from December 2001 to November 2002 at 2200 m water depth south of Java in the eastern Indian Ocean. We investigate the seasonality of alkenone and GDGT fluxes as well as the potential habitat depth of the Thaumarchaeota producing the GDGTs entrained in sinking particles. The alkenone flux shows a pronounced seasonality and ranges from 1 μg m-2 d-1 to 35 μg m-2 d-1. The highest alkenone flux is observed in late September during the Southeast monsoon, coincident with high total organic carbon fluxes as well as high net primary productivity. Flux-weighted mean temperature for the high flux period using the alkenone-based sea-surface temperature (SST) index U37K‧ is 26.7 °C, which is similar to satellite-derived Southeast (SE) monsoon SST (26.4 °C). The GDGT flux displays a weaker seasonality than that of the alkenones. It is elevated during the SE monsoon period compared to the Northwest (NW) monsoon and intermonsoon periods (approximately 2.5 times), which is probably related to seasonal variation of the abundance of Thaumarchaeota, or to enhanced export of GDGTs by aggregation with sinking phytoplankton detritus. Flux-weighted mean temperature inferred from the GDGT-based TEX86H index is 26.2 °C, which is 1.8 °C lower than mean annual (ma) SST but similar to SE monsoon SST. As the time series of TEX86H temperature estimates, however, does not record a strong seasonal amplitude, we infer that TEX86H reflects ma upper thermocline temperature at approximately 50 m water depth.

  6. The alkaline single cell electrophoresis assay with eight mouse organs: results with 22 mono-functional alkylating agents (including 9 dialkyl N-nitrosoamines) and 10 DNA crosslinkers.

    PubMed

    Tsuda, S; Matsusaka, N; Madarame, H; Miyamae, Y; Ishida, K; Satoh, M; Sekihashi, K; Sasaki, Y F

    2000-04-13

    The genotoxicity of 22 mono-functional alkylating agents (including 9 dialkyl N-nitrosoamines) and 10 DNA crosslinkers selected from IARC (International Agency for Research on Cancer) groups 1, 2A, and 2B was evaluated in eight mouse organs with the alkaline single cell gel electrophoresis (SCGE) (comet) assay. Groups of four mice were treated once intraperitoneally at the dose at which micronucleus tests had been conducted, and the stomach, colon, liver, kidney, bladder, lung, brain, and bone marrow were sampled 3, 8, and/or 24 h later. All chemicals were positive in the SCGE assay in at least one organ. Of the 22 mono-functional alkylating agents, over 50% were positive in all organs except the brain and bone marrow. The two subsets of mono-functional alkylating agents differed in their bone marrow genotoxicity: only 1 of the 9 dialkyl N-nitrosoamines was positive in bone marrow as opposed to 8 of the 13 other alkylating agents, reflecting the fact that dialkyl N-nitrosoamines are poor micronucleus inducers in hematopoietic cells. The two groups of mono-functional alkylating agents also differ in hepatic carcinogenicity in spite of the fact that they are similar in hepatic genotoxicity. While dialkyl N-nitrosoamines produce tumors primarily in mouse liver, only one (styrene-7,8-oxide) out of 10 of the other type of mono-functional alkylating agents is a mouse hepatic carcinogen. Taking into consideration our previous results showing high concordance between hepatic genotoxicity and carcinogenicity for aromatic amines and azo compounds, a possible explanation for the discrepancy might be that chemicals that require metabolic activation show high concordance between genotoxicity and carcinogenicity in the liver. A high percent of the 10 DNA crosslinkers were positive in the SCGE assay in the gastrointestinal mucosa, but less than 50% were positive in the liver and lung. In this study, we allowed 10 min alkali-unwinding to obtain low and stable control values

  7. Migratory insertion reactions of indenyliridium dialkyls and alkyl and aryl hydrides

    SciTech Connect

    Foo, T.; Bergman, R.G. |

    1992-05-01

    This paper reports the migratory insertion chemistry of indenyliridium complexes described in the companion paper. Complexes of general formula ({eta}{sup 5}-Ind)(PMe{sub 3})Ir(R)(R{prime}), where R = alkyl or aryl and R{prime} = alkyl, aryl, or hydride (4-6) react with dative ligands L such as tert-butylisocyanide and CO. These transformations lead to {eta}{sup 5} to {eta}{sup 1} isomerization of the indenyl ligand, giving octahedral iridium complexes of general formula ({eta}{sup 1}-Ind)(PMe{sub 3})(L){sub 2}Ir(R)(R{prime}) (8, 9, 11). Treatment of the methyl aryl and dimethyl {eta}{sup 1}-indenyl complexes 9a, 9d, and 9e with trimethylamine oxide removes CO, allowing the indenyl ligand to reestablish {eta}{sup 5}-coordination by inducing CO migratory insertion to give acyl complexes 10. Reaction of {eta}{sup 1}-indenyl aryl and methyl hydrides 6 (as well as the dihydride ({eta}{sup 5}-Ind)(PMe{sub 3})IrH{sub 2} (7)) with CO leads to reductive elimination of arene, methane, or H{sub 2} rather than migratory insertion, forming ({eta}{sup 1}-Ind)-(CO){sub 3}(PMe{sub 3})Ir (12) as the organometallic product. In contrast, treatment of methyl and aryl hydrides 6 with alkynes leads to the methyl vinyl complexes ({eta}{sup 5}-Ind)(PMe{sub 3})Ir(Me)(CR{double_prime}C(R{prime})(H)) (13) and reaction of 6a with ethylene gives the methyl ethyl complex ({eta}{sup 5}-Ind)(PMe{sub 3})Ir(Me)(Et) (14). Isotope labeling, stereochemical, and kinetic studies have been carried out on the insertion reaction of 6a with 3,3-dimethyl-1-butyne. The results of these experiments are most consistent with a mechanism involving initial reversible coordination of alkyne to the metal center (probably with concurrent {eta}{sup 5}-{eta}{sup 3} isomerization of the indenyl ligand) followed by irreversible migration of the metal-bound hydrogen to the tert-butyl-substituted carbon of the alkyne and then rapid recoordination of the indenyl group. 22 refs., 3 figs., 2 tabs.

  8. Radiation Chemistry

    NASA Astrophysics Data System (ADS)

    Wojnárovits, L.

    Ionizing radiation causes chemical changes in the molecules of the interacting medium. The initial molecules change to new molecules, resulting in changes of the physical, chemical, and eventually biological properties of the material. For instance, water decomposes to its elements H2 and O2. In polymers, degradation and crosslinking take place. In biopolymers, e.g., DNS strand breaks and other alterations occur. Such changes are to be avoided in some cases (radiation protection), however, in other cases they are used for technological purposes (radiation processing). This chapter introduces radiation chemistry by discussing the sources of ionizing radiation (radionuclide sources, machine sources), absorption of radiation energy, techniques used in radiation chemistry research, and methods of absorbed energy (absorbed dose) measurements. Radiation chemistry of different classes of inorganic (water and aqueous solutions, inorganic solids, ionic liquids (ILs)) and organic substances (hydrocarbons, halogenated compounds, polymers, and biomolecules) is discussed in concise form together with theoretical and experimental backgrounds. An essential part of the chapter is the introduction of radiation processing technologies in the fields of polymer chemistry, food processing, and sterilization. The application of radiation chemistry to nuclear technology and to protection of environment (flue gas treatment, wastewater treatment) is also discussed.

  9. Polymer Chemistry

    NASA Technical Reports Server (NTRS)

    Williams, Martha; Roberson, Luke; Caraccio, Anne

    2010-01-01

    This viewgraph presentation describes new technologies in polymer and material chemistry that benefits NASA programs and missions. The topics include: 1) What are Polymers?; 2) History of Polymer Chemistry; 3) Composites/Materials Development at KSC; 4) Why Wiring; 5) Next Generation Wiring Materials; 6) Wire System Materials and Integration; 7) Self-Healing Wire Repair; 8) Smart Wiring Summary; 9) Fire and Polymers; 10) Aerogel Technology; 11) Aerogel Composites; 12) Aerogels for Oil Remediation; 13) KSC's Solution; 14) Chemochromic Hydrogen Sensors; 15) STS-130 and 131 Operations; 16) HyperPigment; 17) Antimicrobial Materials; 18) Conductive Inks Formulations for Multiple Applications; and 19) Testing and Processing Equipment.

  10. Chemistry Experiments

    NASA Technical Reports Server (NTRS)

    Brasseur, Guy; Remsberg, Ellis; Purcell, Patrick; Bhatt, Praful; Sage, Karen H.; Brown, Donald E.; Scott, Courtney J.; Ko, Malcolm K. W.; Tie, Xue-Xi; Huang, Theresa

    1999-01-01

    The purpose of the chemistry component of the model comparison is to assess to what extent differences in the formulation of chemical processes explain the variance between model results. Observed concentrations of chemical compounds are used to estimate to what degree the various models represent realistic situations. For readability, the materials for the chemistry experiment are reported in three separate sections. This section discussed the data used to evaluate the models in their simulation of the source gases and the Nitrogen compounds (NO(y)) and Chlorine compounds (Cl(y)) species.

  11. Structures of Plutonium(IV) and Uranium(VI) with N,N-Dialkyl Amides from Crystallography, X-ray Absorption Spectra, and Theoretical Calculations.

    PubMed

    Acher, Eléonor; Hacene Cherkaski, Yanis; Dumas, Thomas; Tamain, Christelle; Guillaumont, Dominique; Boubals, Nathalie; Javierre, Guilhem; Hennig, Christoph; Solari, Pier Lorenzo; Charbonnel, Marie-Christine

    2016-06-01

    The structures of plutonium(IV) and uranium(VI) ions with a series of N,N-dialkyl amides ligands with linear and branched alkyl chains were elucidated from single-crystal X-ray diffraction (XRD), extended X-ray absorption fine structure (EXAFS), and theoretical calculations. In the field of nuclear fuel reprocessing, N,N-dialkyl amides are alternative organic ligands to achieve the separation of uranium(VI) and plutonium(IV) from highly concentrated nitric acid solution. EXAFS analysis combined with XRD shows that the coordination structure of U(VI) is identical in the solution and in the solid state and is independent of the alkyl chain: two amide ligands and four bidentate nitrate ions coordinate the uranyl ion. With linear alkyl chain amides, Pu(IV) also adopt identical structures in the solid state and in solution with two amides and four bidentate nitrate ions. With branched alkyl chain amides, the coordination structure of Pu(IV) was more difficult to establish unambiguously from EXAFS. Density functional theory (DFT) calculations were consequently performed on a series of structures with different coordination modes. Structural parameters and Debye-Waller factors derived from the DFT calculations were used to compute EXAFS spectra without using fitting parameters. By using this methodology, it was possible to show that the branched alkyl chain amides form partly outer-sphere complexes with protonated ligands hydrogen bonded to nitrate ions. PMID:27171842

  12. A joint experimental and theoretical investigation of kinetics and mechanistic study in a synthesis reaction between triphenylphosphine and dialkyl acetylenedicarboxylates in the presence of benzhydrazide.

    PubMed

    Kazemian, Mohammad Amin; Habibi-Khorassani, Sayyed Mostafa; Ebrahimi, Ali; Maghsoodlou, Malek Taher; Jahani, Peyman Mohammadzadeh; Ghahramaninezhad, Mahbobeh

    2012-12-01

    Stable crystalline phosphorus ylides were obtained in excellent yields from the 1:1:1 addition reaction between triphenylphosphine (TPP) and dialkyl acetylenedicarboxylates, in the presence of NH-acids, such as benzhydrazide. To determine the kinetic parameters of the reactions, they were monitored by UV spectrophotometery. The second order fits were automatically drawn and the values of the second order rate constant (k(2)) were calculated using standard equations within the program. At the temperature range studied the dependence of the second order rate constant (Ln k(2)) on reciprocal temperature was compatible with Arrhenius equation. This provided the relevant plots to calculate the activation energy of all reactions. Furthermore, useful information were obtained from studies of the effect of solvent, structure of reactants (different alkyl groups within the dialkyl acetylenedicarboxylates) and also concentration of reactants on the rate of reactions. On the basis of experimental data the proposed mechanism was confirmed according to the obtained results and a steady state approximation and the first step (k(2)) and third (k(3)) steps of the reactions were recognized as the rate determining steps, respectively. In addition, three speculative proposed mechanisms were theoretically investigated using quantum mechanical calculation. The results, arising from the second and third speculative mechanisms, were far from the experimental data. Nevertheless, there was a good agreement between the theoretical kinetic data, emerge from the first speculative mechanism, and experimental kinetic data of proposed mechanism.

  13. Model dialkyl peroxides of the fenton mechanistic probe 2-methyl-1-phenyl-2-propyl hydroperoxide (MPPH): kinetic probes for dissociative electron transfer.

    PubMed

    Magri, David C; Workentin, Mark S

    2003-10-01

    Two dialkyl peroxides, devised as kinetic probes for the heterogeneous electron transfer (ET), are studied using heterogeneous and homogeneous electrochemical techniques. The peroxides react by concerted dissociative ET reduction of the O-O bond. Under heterogeneous conditions, the only products isolated are the corresponding alcohols from a two-electron reduction as has been observed with other dialkyl peroxides studied to date. However, under homogeneous conditions, a generated alkoxyl radical undergoes a rapid beta-scission fragmentation in competition with the second ET resulting in formation of acetone and a benzyl radical. With knowledge of the rate constant for fragmentation and accounting for the diffuse double layer at the electrode interface, the heterogeneous ET rate constant to the alkoxyl radicals is estimated to be 1500 cm s(-1). The heterogeneous and homogeneous ET kinetics of the O-O bond cleavage have also been measured and examined as a function of the driving force for ET, deltaG(ET), using dissociative electron transfer theory. From both sets of kinetics, besides the evaluation of thermochemical parameters, it is demonstrated that the heterogeneous and homogeneous reduction of the O-O bond appears to be non-adiabatic.

  14. Chemistry Notes.

    ERIC Educational Resources Information Center

    School Science Review, 1982

    1982-01-01

    Presents procedures, experiments, demonstrations, teaching suggestions, and information on a variety of chemistry topics including, for example, inert gases, light-induced reactions, calculators, identification of substituted acetophenones, the elements, analysis of copper minerals, extraction of metallic strontium, equilibrium, halogens, and…

  15. Chemistry Notes.

    ERIC Educational Resources Information Center

    School Science Review, 1983

    1983-01-01

    Presents chemistry experiments, laboratory procedures, demonstrations, teaching suggestions, and classroom materials/activities. These include: game for teaching ionic formulas; method for balancing equations; description of useful redox series; computer programs (with listings) for water electrolysis simulation and for determining chemical…

  16. Chemistry Notes

    ERIC Educational Resources Information Center

    School Science Review, 1972

    1972-01-01

    Short articles on the kinetics of the hydrogen peroxide-iodide ion reaction, simulation of fluidization catalysis, the use of Newman projection diagrams to represent steric relationships in organic chemistry, the use of synthetic substrates for proteolytic enzyme reactions, and two simple clock reactions"--hydrolysis of halogenoalkanes and…

  17. Chemistry Notes

    ERIC Educational Resources Information Center

    School Science Review, 1972

    1972-01-01

    Short articles on the alkylation of aniline, the preparation and properties of perbromate, using scrap copper in chemistry instruction, a safe method of burning hydrogen, and the use of an ion-charge model as an alternative to the mole concept in secondary school instruction. (AL)

  18. Confectionary Chemistry.

    ERIC Educational Resources Information Center

    Levine, Elise Hilf

    1996-01-01

    Presents activities and demonstrations that enable teachers to use various types of confections as tactile experiences to spark chemistry students' interest and generate enthusiasm for learning. Presents uses of candy in teaching about atomic structure, spontaneous nuclear decay, chemical formulas, fractoluminescence, the effect of a molecular…

  19. Chemistry Notes

    ERIC Educational Resources Information Center

    School Science Review, 1976

    1976-01-01

    Describes several chemistry projects, including solubility, formula for magnesium oxide, dissociation of dinitrogen tetroxide, use of 1-chloro-2, 4-dinitrobenzene, migration of ions, heats of neutralizations, use of pocket calculators, sonic cleaning, oxidation states of manganese, and cell potentials. Includes an extract from Chemical Age on…

  20. Chemistry Notes.

    ERIC Educational Resources Information Center

    School Science Review, 1983

    1983-01-01

    Presents chemistry experiments, laboratory procedures, demonstrations, and classroom materials/activities. These include: experiments on colloids, processing of uranium ore, action of heat on carbonates; color test for phenols and aromatic amines; solvent properties of non-electrolytes; stereoscopic applications/methods; a valency balance;…

  1. Chemistry Notes.

    ERIC Educational Resources Information Center

    School Science Review, 1978

    1978-01-01

    Describes some laboratory apparatus, chemistry experiments and demonstrations, such as a Kofler block melting point apparatus, chromatographic investigation of the phosphoric acid, x-ray diffraction, the fountain experiment, endothermic sherbet, the measurement of viscosity, ionization energies and electronic configurations. (GA)

  2. Chemistry Notes.

    ERIC Educational Resources Information Center

    School Science Review, 1980

    1980-01-01

    Presents 12 chemistry notes for British secondary school teachers. Some of these notes are: (1) a simple device for testing pH-meters; (2) portable fume cupboard safety screen; and (3) Mass spectroscopy-analysis of a mass peak. (HM)

  3. Bis(dialkyl)dithiocarbamato cobalt(III) complexes of bidentate nitrogen mustards: synthesis, reduction chemistry and biological evaluation as hypoxia-selective cytotoxins.

    PubMed

    Ware, D C; Palmer, H R; Pruijn, F B; Anderson, R F; Brothers, P J; Denny, W A; Wilson, W R

    1998-03-01

    Cobalt(III) complexes [Co(R2dtc)2(L)]+ containing two dithiocarbamate ligands (R = Me, Et, pyrrolidine) and a bidentate nitrogen mustard ligand (L) have been prepared as potential hypoxia-selective cytotoxins. The complexes were synthesized by treatment of the binuclear precursor [Co2(R2dtc)5]+ with the diamine mustards N,N'-bis(2-chloroethyl)ethylenediamine (BCE) and N,N-bis(2-chloroethyl)ethylenediamine (DCE), or their non-alkylating analogues [N,N-diethylethylenediamine (DEE) and N,N'-diethylethylenediamine (BEE)]. Cyclic voltammetry of the complexes in MeCN reveals quasi-reversible behaviour for the Co(III)/Co(II) couple, with E1/2 increasing in the order DCE < DEE approximately BCE < BEE. In MeCN/H2O electrochemical reduction is irreversible, indicating rapid substitution of H2O into the coordination sphere of the Co(II) intermediate. This fast ligand loss was confirmed by pulse radiolysis of [Co(Me2dtc)2(DEE)]+, while steady-state radiolysis showed that the initial intermediate disproportionates to [CoII(H2O)6]2+ + 2[CoII(Me2dtc)3]. The latter species reduces additional parent complex to give an overall stoichiometry of 3 mol parent complex/mol reductant. [Co(Me2dtc)2(DCE)]+ decays rapidly by an analogous mechanism in hypoxic culture medium. This reaction is not inhibited by O2, indicating that reoxidation of the Co(II) intermediate by O2 is not rapid enough to compete with ligand dissociation. The resulting free R2dtc-ligands, rather than the released mustards, are primarily responsible for growth inhibition by [Co(R2dtc)2(L)]+ complexes, although DCE release does contribute to clonogenic cell killing. Clonogenic cell killing is not appreciably enhanced under hypoxic conditions for any of the dithiocarbamato complexes. This finding, coupled with their instability in culture medium, suggests that [Co(R2dtc)2(L)]+ complexes are probably not suited for further development as bioreductive anticancer drugs.

  4. Chemistry of metal oxo alkyl complexes. Mechanistic studies on the anaerobic and aerobic decompositions of molybdenum(VI) dioxo dialkyl complexes

    SciTech Connect

    Vetter, W.M.; Sen, A. )

    1991-01-01

    The anaerobic and aerobic decompositions of L{sub 2}Mo(O){sub 2}R{sub 2} (L{sub 2} = 4,4{prime}-dimethyl-2,2{prime}-dipyridyl, R = CH{sub 2}Ph, 1; R = CH{sub 2}C{sub 6}H{sub 4}CH{sub 3}-p, 2; R = (CH{sub 2}){sub 4}CH:CH{sub 2}, 3; R = CH{sub 2}CHMe{sub 2}, 4; R = CH{sub 2}CMe{sub 3}, 5; R = CH{sub 2}CMe{sub 2}Ph, 6) were studied. The anaerobic decomposition mode chosen by a given L{sub 2}Mo(O){sub 2}R{sub 2} complex is a sensitive function of the hydrocarbyl group, R. If accessible {beta}-hydrogens are present on R (as in 3 and 4), equal amounts of alkane and alkene are formed through a {beta}-hydrogen abstraction pathway. In the case of 4, an additional pathway involving Mo-R bond homolysis accounts for 10% of the products formed. When {beta}-hydrogens are absent from R (as in 1, 2, and 6), the free radical, R{sup {sm bullet}}, formed by Mo-R bond homolysis is the predominant product. The reaction of the L{sub 2}Mo(O){sub 2}R{sub 2} complexes with O{sub 2} appears to proceed almost exclusively through the intermediacy of the free radical, R{sup {sm bullet}}. In inert solvents, the principal organic product is the corresponding aldehyde, and the role of O{sub 2} in its formation from L{sub 2}Mo(O){sub 2}R{sub 2} is 2-fold: (a) O{sub 2} promotes the homolysis of the Mo-R bond to form R{sup {sm bullet}}, and (b) O{sub 2} traps the resultant radical to yield the aldehyde. Labeling studies indicated that O{sub 2}, rather than the Mo{double bond}O group, was the predominant source of oxygen for the aldehydes. Mechanistic implications of the authors' observations for the heterogeneous oxidation of alkanes and alkenes by Mo(VI)- and V(V)-oxo species are discussed.

  5. Bis(dialkyl)dithiocarbamato cobalt(III) complexes of bidentate nitrogen mustards: synthesis, reduction chemistry and biological evaluation as hypoxia-selective cytotoxins.

    PubMed

    Ware, D C; Palmer, H R; Pruijn, F B; Anderson, R F; Brothers, P J; Denny, W A; Wilson, W R

    1998-03-01

    Cobalt(III) complexes [Co(R2dtc)2(L)]+ containing two dithiocarbamate ligands (R = Me, Et, pyrrolidine) and a bidentate nitrogen mustard ligand (L) have been prepared as potential hypoxia-selective cytotoxins. The complexes were synthesized by treatment of the binuclear precursor [Co2(R2dtc)5]+ with the diamine mustards N,N'-bis(2-chloroethyl)ethylenediamine (BCE) and N,N-bis(2-chloroethyl)ethylenediamine (DCE), or their non-alkylating analogues [N,N-diethylethylenediamine (DEE) and N,N'-diethylethylenediamine (BEE)]. Cyclic voltammetry of the complexes in MeCN reveals quasi-reversible behaviour for the Co(III)/Co(II) couple, with E1/2 increasing in the order DCE < DEE approximately BCE < BEE. In MeCN/H2O electrochemical reduction is irreversible, indicating rapid substitution of H2O into the coordination sphere of the Co(II) intermediate. This fast ligand loss was confirmed by pulse radiolysis of [Co(Me2dtc)2(DEE)]+, while steady-state radiolysis showed that the initial intermediate disproportionates to [CoII(H2O)6]2+ + 2[CoII(Me2dtc)3]. The latter species reduces additional parent complex to give an overall stoichiometry of 3 mol parent complex/mol reductant. [Co(Me2dtc)2(DCE)]+ decays rapidly by an analogous mechanism in hypoxic culture medium. This reaction is not inhibited by O2, indicating that reoxidation of the Co(II) intermediate by O2 is not rapid enough to compete with ligand dissociation. The resulting free R2dtc-ligands, rather than the released mustards, are primarily responsible for growth inhibition by [Co(R2dtc)2(L)]+ complexes, although DCE release does contribute to clonogenic cell killing. Clonogenic cell killing is not appreciably enhanced under hypoxic conditions for any of the dithiocarbamato complexes. This finding, coupled with their instability in culture medium, suggests that [Co(R2dtc)2(L)]+ complexes are probably not suited for further development as bioreductive anticancer drugs. PMID:9524553

  6. Wide distribution of autochthonous branched glycerol dialkyl glycerol tetraethers (bGDGTs) in U.S. Great Basin hot springs.

    PubMed

    Hedlund, Brian P; Paraiso, Julienne J; Williams, Amanda J; Huang, Qiuyuan; Wei, Yuli; Dijkstra, Paul; Hungate, Bruce A; Dong, Hailiang; Zhang, Chuanlun L

    2013-01-01

    Branched glycerol dialkyl glycerol tetraethers (bGDGTs) are membrane-spanning lipids that likely stabilize membranes of some bacteria. Although bGDGTs have been reported previously in certain geothermal environments, it has been suggested that they may derive from surrounding soils since bGDGTs are known to be produced by soil bacteria. To test the hypothesis that bGDGTs can be produced by thermophiles in geothermal environments, we examined the distribution and abundance of bGDGTs, along with extensive geochemical data, in 40 sediment and mat samples collected from geothermal systems in the U.S. Great Basin (temperature: 31-95°C; pH: 6.8-10.7). bGDGTs were found in 38 out of 40 samples at concentrations up to 824 ng/g sample dry mass and comprised up to 99.5% of total GDGTs (branched plus isoprenoidal). The wide distribution of bGDGTs in hot springs, strong correlation between core and polar lipid abundances, distinctness of bGDGT profiles compared to nearby soils, and higher concentration of bGDGTs in hot springs compared to nearby soils provided evidence of in situ production, particularly for the minimally methylated bGDGTs I, Ib, and Ic. Polar bGDGTs were found almost exclusively in samples ≤70°C and the absolute abundance of polar bGDGTs correlated negatively with properties of chemically reduced, high temperature spring sources (temperature, H2S/HS(-)) and positively with properties of oxygenated, low temperature sites (O2, NO(-) 3). Two-way cluster analysis and nonmetric multidimensional scaling based on relative abundance of polar bGDGTs supported these relationships and showed a negative relationship between the degree of methylation and temperature, suggesting a higher abundance for minimally methylated bGDGTs at high temperature. This study presents evidence of the widespread production of bGDGTs in mats and sediments of natural geothermal springs in the U.S. Great Basin, especially in oxygenated, low-temperature sites (≤70°C).

  7. In situ produced branched glycerol dialkyl glycerol tetraethers in suspended particulate matter from the Yenisei River, Eastern Siberia

    NASA Astrophysics Data System (ADS)

    De Jonge, Cindy; Stadnitskaia, Alina; Hopmans, Ellen C.; Cherkashov, Georgy; Fedotov, Andrey; Sinninghe Damsté, Jaap S.

    2014-01-01

    Soil-derived branched glycerol dialkyl glycerol tetraethers (brGDGTs) in marine river fan sediments have a potential use for determining changes in the mean annual temperature (MAT) and pH of the river watershed soils. Prior to their incorporation in marine sediments, the compounds are transported to the marine system by rivers. However, emerging evidence suggests that the brGDGTs in freshwater systems can be derived from both soil run-off and in situ production. The production of brGDGTs in the river system can complicate the interpretation of the brGDGT signal delivered to the marine system. Therefore, we studied the distribution of brGDGT lipids in suspended particulate matter (SPM) of the Yenisei River. Chromatographic improvements allowed quantification of the recently described hexamethylated brGDGT isomer, characterized by having two methyl groups at the 6/6‧ instead of the 5/5‧ positions, in an environmental dataset for the first time. This novel compound was the most abundant brGDGT in SPM from the Yenisei. Its fractional abundance correlated well with that of the 6-methyl isomer of the hexamethylated brGDGT that contains one cyclopentane moiety. The Yenisei River watershed is characterized by large differences in MAT (>11 °C) as it spans a large latitudinal range (46-73°N), which would be expected to be reflected in brGDGT distributions of its soils. However, the brGDGT distributions in its SPM show little variation. Furthermore, the reconstructed pH values are high compared to the watershed soil pH. We, therefore, hypothesize that the brGDGTs in the Yenisei River SPM are predominantly produced in situ and not primarily derived from erosion of soil. This accounts for the absence of a change in the temperature signal, as the river water temperature is more stable. Using a lake calibration, the reconstructed temperature values agree with the mean summer temperatures (MST) recorded. The brGDGTs delivered to the sea by the Yenisei River during this

  8. Circumstellar chemistry

    NASA Technical Reports Server (NTRS)

    Glassgold, A. E.; Mamon, G. A.

    1991-01-01

    Recent theoretical studies of circumstellar chemistry are discussed for both red-giant and protostellar winds. The generalized photochemical model is able to account for the recently discovered silicon-bearing molecules in the prototypical, C-rich, AGB star IRC + 10216. The surprising occurrence of CO in protostellar winds that are largely atomic is interpreted to be the result of the high density and the rapid decrease of the temperature with distance that is expected for such winds.

  9. Computational chemistry

    NASA Technical Reports Server (NTRS)

    Arnold, J. O.

    1987-01-01

    With the advent of supercomputers, modern computational chemistry algorithms and codes, a powerful tool was created to help fill NASA's continuing need for information on the properties of matter in hostile or unusual environments. Computational resources provided under the National Aerodynamics Simulator (NAS) program were a cornerstone for recent advancements in this field. Properties of gases, materials, and their interactions can be determined from solutions of the governing equations. In the case of gases, for example, radiative transition probabilites per particle, bond-dissociation energies, and rates of simple chemical reactions can be determined computationally as reliably as from experiment. The data are proving to be quite valuable in providing inputs to real-gas flow simulation codes used to compute aerothermodynamic loads on NASA's aeroassist orbital transfer vehicles and a host of problems related to the National Aerospace Plane Program. Although more approximate, similar solutions can be obtained for ensembles of atoms simulating small particles of materials with and without the presence of gases. Computational chemistry has application in studying catalysis, properties of polymers, all of interest to various NASA missions, including those previously mentioned. In addition to discussing these applications of computational chemistry within NASA, the governing equations and the need for supercomputers for their solution is outlined.

  10. Fluxes and distribution of intact glycerol dialkyl glycerol tetraether membrane lipids in the water column of Lake Challa, East Africa

    NASA Astrophysics Data System (ADS)

    Weijers, J.; Buckles, L.; Verschuren, D.; Sinninghe Damsté, J. S.

    2009-12-01

    Over the last years, glycerol dialkyl glycerol tetraether (GDGT) membrane lipids have become an interesting tool in palaeoclimate research. Both the TEX86 sea surface temperature proxy, based on isoprenoid GDGT membrane lipids derived from pelagic Crenarchaeota, and the MBT/CBT annual mean air temperature proxy, based on the distribution of branched GDGTs derived from soil bacteria, receive increasing interest to be also applied in lake sediments. Despite successful studies utilizing the TEX86 to reconstruct past lake surface temperatures in two large African lakes, other studies indicated that TEX86 values derived from lake surface sediments differed from what would be expected based on the lake surface water temperatures. In addition, in two tropical lake systems, the distribution of branched GDGT lipids in lake surface sediments appeared to differ from that in the surrounding soils. Both situations suggest production of GDGTs by additional sources in some lake systems, hampering application of earlier mentioned temperature proxies. In order to constrain the provenance and flux of GDGT lipids in one of these lakes, Lake Challa, a freshwater crater lake in East Africa, we used a novel separation technique to analyze both intact and core GDGT membrane lipids in monthly samples derived from a sediment trap installed at 35m depth in the lake. Intact GDGT lipids still contain a functional polar head group which is thought to be lost quickly after cell lysis. Therefore, the presence of such intact GDGT lipids is thought indicative for extant life, most likely autochthonous in origin. High fluxes of intact GDGT-0 lipids, maybe derived from methanogenic Archaea residing in anoxic micro niches in descending particles, occur in July and August during a diatom bloom. High fluxes of both the intact and core isoprenoid GDGT lipid crenarchaeol in December and January clearly reflect the bloom of Crenarchaeota. TEX86 values of both the intact and core isoprenoid GDGTs are

  11. Occurrence and abundance of 6-methyl branched glycerol dialkyl glycerol tetraethers in soils: Implications for palaeoclimate reconstruction

    NASA Astrophysics Data System (ADS)

    De Jonge, Cindy; Hopmans, Ellen C.; Zell, Claudia I.; Kim, Jung-Hyun; Schouten, Stefan; Sinninghe Damsté, Jaap S.

    2014-09-01

    The distribution of branched glycerol dialkyl glycerol tetraethers (brGDGTs) in soils has been shown to correlate with the soil pH and the mean annual air temperature (MAT). This has been used to perform palaeoclimate reconstructions based on brGDGTs recovered from palaeosoils, freshwater, and marine sedimentary archives. Recently described 6-methyl brGDGTs were shown to co-elute with the 5-methyl brGDGTs that are used to calculate the CBT and MBT‧ indices used as palaeoclimate proxies. The impact of these 6-methyl brGDGTs on the established palaeoclimate proxies is unknown and will depend on their abundance in soils. Using improved chromatography, we quantified the fractional abundance of 6-methyl brGDGTs in globally distributed soils and show that they are abundant components, comprising on average 24% of the total amount of brGDGTs. All penta- and hexa-methylated brGDGTs (i.e. with zero to two cyclopentane moieties) were shown to comprise both 5- and 6-methyl isomers. The fractional abundances of the six 6-methyl brGDGTs correlate positively with each other, suggesting a common biological source in most soils, and correlate strongly with soil pH. The presence of the 6-methyl brGDGTs introduced scatter in the original MBT‧/CBT-MAT calibration and caused a dependence on soil pH of the MBT‧. Exclusion of the 6-methyl brGDGTs from the MBT‧, i.e. the newly defined MBT‧5ME, shows that it is no longer related to soil pH. The correlation with MAT is improved, reducing the residual mean error (RMSE) from 6.2 to 4.8 °C. Also, the correlation of the CBT after the exclusion of the 6-methyl brGDGTs (defined as CBT5ME) with soil pH slightly improved. Furthermore, the separate quantification of the 6-methyl brGDGTs allows the definition of new indices. The CBT‧, which comprises the 6-methyl brGDGTs, is a substantially improved alternative to the CBT5ME, reducing the RMSE from 0.8 to 0.5 pH units. Also, the accuracy of MAT reconstructions can be improved using a

  12. Recipe for new diorganostannates, [R2Sn(OS(O)2R1)4]2-, bearing alkanesulfonate groups using dialkyl sulfite as the reagent.

    PubMed

    Shankar, Ravi; Singh, Atul Pratap; Mahon, Mary F; Molloy, Kieran C; Hundal, Geeta; Biesemans, Monique; Willem, Rudolph

    2008-02-01

    A one-pot reaction between di-n-propyl/di-n-butyltin oxide, dialkyl sulfite, and triethylamine or tetra-n-alkylammonium iodide proceeds under ambient conditions (110-120 degrees C, 20 h) via sulfur-centered Arbuzov rearrangement to afford the corresponding dianionic tetraalkanesulfonato diorganostannates [R2Sn(OSO2Me)4].2Et3NMe [R = n-Pr (1), n-Bu (2)] as well as [n-Bu(2)Sn(OSO(2)R(1))(4)].(2)R(2)(4)N [R(1) = Me, Et, n-Pr; R(2) = Et (3, 5, and 7), n-Bu (4, 6, and 8)]. X-ray crystal structures of 2 and 3 reveal a monomeric motif of the dianion, with methanesulfonate groups acting as unidentate ligands. The (119)Sn NMR spectral studies suggest the existence of pentacoordinated tin species in solution.

  13. (Pesticide chemistry)

    SciTech Connect

    Barnthouse, L.W.

    1990-09-04

    This report summarizes a trip by L. W. Barnthouse of the Environmental Sciences Division (ESD), Oak Ridge National Laboratory (ORNL), to Hamburg, Federal Republic of Germany (FRG), where he participated in the 7th International Congress of Pesticide Chemistry. He chaired a workshop on experimental systems for determining effects of pesticides on nontarget organisms and gave an oral presentation at a symposium on pesticide risk assessment. Before returning to the United States, Dr. Barnthouse visited the Netherlands Institute for Sea Research in Texel, the Netherlands.

  14. Provocative Opinion: Descriptive Chemistry.

    ERIC Educational Resources Information Center

    Bent, Henry A.; Bent, Brian E.

    1987-01-01

    Discusses many of the distinctions that chemists draw between theoretical chemistry and descriptive chemistry, along with the tendency for chemical educators to adopt the type of chemistry they feel is most important to teach. Uses examples to argue that theoretical chemistry and descriptive chemistry are, at the bottom line, the same. (TW)

  15. Combustion chemistry

    SciTech Connect

    Brown, N.J.

    1993-12-01

    This research is concerned with the development and use of sensitivity analysis tools to probe the response of dependent variables to model input variables. Sensitivity analysis is important at all levels of combustion modeling. This group`s research continues to be focused on elucidating the interrelationship between features in the underlying potential energy surface (obtained from ab initio quantum chemistry calculations) and their responses in the quantum dynamics, e.g., reactive transition probabilities, cross sections, and thermal rate coefficients. The goals of this research are: (i) to provide feedback information to quantum chemists in their potential surface refinement efforts, and (ii) to gain a better understanding of how various regions in the potential influence the dynamics. These investigations are carried out with the methodology of quantum functional sensitivity analysis (QFSA).

  16. Why Teach Environmental Chemistry?

    ERIC Educational Resources Information Center

    Gardner, Marjorie H.

    1974-01-01

    Discusses the importance of teaching environmental chemistry in secondary school science classes, and outlines five examples of environmental chemistry problems that focus on major concepts of chemistry and have critical implications for human survival and well-being. (JR)

  17. Science Update: Inorganic Chemistry

    ERIC Educational Resources Information Center

    Rawls, Rebecca

    1978-01-01

    This first in a series of articles describing the state of the art of various branches of chemistry reviews inorganic chemistry, including bioinorganic, photochemistry, organometallic, and solid state chemistries. (SL)

  18. Science Update: Inorganic Chemistry.

    ERIC Educational Resources Information Center

    Rawls, Rebecca

    1981-01-01

    Describes areas of inorganic chemistry which have changed dramatically in the past year or two, including photochemistry, electrochemistry, organometallic complexes, inorganic reaction theory, and solid state chemistry. (DS)

  19. Study on selective separation of uranium(VI) by new N,N-dialkyl carboxy-amides

    SciTech Connect

    Suzuki, Shinichi; Sugo, Yumi; Kimura, Takaumi; Yaita, Tsuyoshi

    2007-07-01

    -amides and group separation of Pu-Np linear alkyl type N,N-di-alkyl carboxy-amide for FBR and LWR spent fuel treatment. Since the branched alkyl type N,N-di-alkyl carboxy-amides have the steric hindrance on the complexation with metal cations, branched alkyl type N,N-di-alkyl carboxy-amides can be used to separate An(VI) from An(IV). On the other hand, linear type N,N-di-alkyl carboxy-amides have potential for alternative extractant for tri-butyl phosphate(TBP) because linear type N,N-di-alkyl-amide can extract An(VI) and An(IV). In our previous research work, we have proposed N,N-di-(2- ethyl)hexyl-(2,2-dimethyl)-propanamide (D2EHDMPA) as a candidate extractant for uranium selective separation in FBR spent fuel treatments. However D2EHDMPA was able to separate uranium(VI) from plutonium(IV) and neptunium(VI), D2EHDMPA showed poor U(VI) loading capacity in organic phase. For the purpose of improvement of U(VI) loading capacity in organic phase, nineteenth kinds of New N,N-di-alkyl-amides: N,N-di-hexyl-(3,3-dimethyl)butanamide (DHDMBA), N,N-di-oxyl-(3,3-dimethyl)butanamide (DODMBA), N,N-di-hexyl-(2,2-dimethyl)propanamide (DHDMPA) N,N-di-octyl-(2,2-dimethyl)propanamide (DODMPA), N,N-di-octyl-(2-ethyl)butanamide (DO2EBA), N,N-di-hexyl-(2-ethyl)butanamide (DH2EBA), N-benzyl-N-R{sub 1}-(2-ethyl)hexanamide (R{sub 1}:- C{sub 4}H{sub 9}, -C{sub 6} H{sub 13}, -C{sub 8} H{sub 17}, N-cyclohexyl-N-R{sub 1}-(2- ethyl)hexanamide (R{sub 1}:-C{sub 4}H{sub 9}, -C{sub 6} H{sub 13}, -C{sub 8} H{sub 17}), N-phenyl- N-R{sub 1}-(2-ethyl)hexanamide (R{sub 1}:-C{sub 3}H{sub 9}, -C{sub 4} H{sub 9}, -C{sub 5} H{sub 11}, - C{sub 6}H{sub 13}, -C{sub 8}H{sub 17}, N-(2-ethyl)hexyl-N-Phenyl-octanamide, N-Benzyl- N-Phenyl-(2-ethyl)hexanamide are synthesized. In this paper, our experimental results of new N,N-dialkyl carboxy-amides extraction property of U(VI)/Pu(IV), extraction of macro amount of U(VI), and gamma-ray radiolysis will be summarized. Solvent extraction of U(VI) and Pu (IV) by nineteenth kinds

  20. Trace Chemistry

    NASA Technical Reports Server (NTRS)

    Radhakrishnan, Krishnan; Whitefield, Philip

    1999-01-01

    The goals of the trace chemistry group were to identify the processes relevant to aerosol and aerosol precursor formation occurring within aircraft gas turbine engines; that is, within the combustor, turbine, and nozzle. The topics of discussion focused on whether the chemistry of aerosol formation is homogeneous or heterogeneous; what species are important for aerosol and aerosol precursor formation; what modeling/theoretical activities to pursue; what experiments to carry out that both support modeling activities and elucidate fundamental processes; and the role of particulates in aerosol and aerosol precursor formation. The consensus of the group was that attention should be focused on SO2, SO3, and aerosols. Of immediate concern is the measurement of the concentration of the species SO3, SO2, H2SO4 OH, HO2, H2O2, O, NO, NO2, HONO, HNO3, CO, and CO2 and particulates in various engines, both those currently in use and those in development. The recommendation was that concentration measurements should be made at both the combustor exit and the engine exit. At each location the above species were classified into one of four categories of decreasing importance, Priority I through IV, as follows: Combustor exit: Priority I species - SO3:SO2 ratio, SO3, SO2, and particulates; Priority II species: OH and O; Priority III species - NO and NO2; and Priority IV species - CO and CO2. For the Engine exit: Priority I species - SO3:SO2 ratio, SO3, SO2,H2SO4, and particulates; Priority II species: OH,HO2, H2O2, and O; Priority III species - NO, NO2, HONO, and HNO3; and Priority IV species - CO and CO2. Table I summarizes the anticipated concentration range of each of these species. For particulate matter, the quantities of interest are the number density, size distribution, and composition. In order to provide data for validating multidimensional reacting flow models, it would be desirable to make 2-D, time-resolved measurements of the concentrations of the above species and

  1. Effect of successive alkylation of N,N-dialkyl amides on the complexation behavior of uranium and thorium: solvent extraction, small angle neutron scattering, and computational studies.

    PubMed

    Verma, Parveen Kumar; Pathak, Priyanath N; Kumari, Neelam; Sadhu, Biswajit; Sundararajan, Mahesh; Aswal, Vinod Kumar; Mohapatra, Prasanta Kumar

    2014-12-11

    The effect of successive alkylation of the Cα atom adjacent to the carbonyl group in N,N-dialkyl amides (i.e., di(2-ethylhexyl)acetamide (D2EHAA), di(2-ethylhexyl)propionamide (D2EHPRA), di(2-ethylhexyl)isobutyramide (D2EHIBA), and di(2-ethylhexyl)pivalamide (D2EHPVA)) on the extraction behavior of hexavalent uranium (U(VI)) and tetravalent thorium (Th(IV)) ions has been investigated. These studies show that the extraction of Th(IV) is significantly suppressed compared to that of U(VI) with increased branching at the Cα atom adjacent to the carbonyl group. Small angle neutron scattering (SANS) studies showed an increased aggregation tendency in the presence of nitric acid and metal ions. D2EHAA showed more aggregation compared to its branched homologues, which explains its capacity for higher extraction of metal ions. These experimental observations were further supported by density function theory calculations, which provided structural evidence of differential binding affinities of these extractants for uranyl cations. The complexation process is primarily controlled by steric and electronic effects. Quantum chemical calculations showed that local hardness and polarizability can be extremely useful inputs for designing novel extractants relevant to a nuclear fuel cycle.

  2. Impact of chain length on antibacterial activity and hemocompatibility of quaternary N-alkyl and n,n-dialkyl chitosan derivatives.

    PubMed

    Sahariah, Priyanka; Benediktssdóttir, Berglind E; Hjálmarsdóttir, Martha Á; Sigurjonsson, Olafur E; Sørensen, Kasper K; Thygesen, Mikkel B; Jensen, Knud J; Másson, Már

    2015-05-11

    A highly efficient method for chemical modification of chitosan biopolymers by reductive amination to yield N,N-dialkyl chitosan derivatives was developed. The use of 3,6-O-di-tert-butyldimethylsilylchitosan as a precursor enabled the first 100% disubstitution of the amino groups with long alkyl chains. The corresponding mono N-alkyl derivatives were also synthesized, and all the alkyl compounds were then quaternized using an optimized procedure. These well-defined derivatives were studied for antibacterial activity against Gram positive S. aureus, E. faecalis, and Gram negative E. coli, P. aeruginosa, which could be correlated to the length of the alkyl chain, but the order was dependent on the bacterial strain. Toxicity against human red blood cells and human epithelial Caco-2 cells was found to be proportional to the length of the alkyl chain. The most active chitosan derivatives were found to be more selective for killing bacteria than the quaternary ammonium disinfectants cetylpyridinium chloride and benzalkonium chloride, as well as the antimicrobial peptides melittin and LL-37. PMID:25830631

  3. Lipase-catalyzed copolymerization of dialkyl carbonate with 1,4-butanediol and ω-pentadecalactone: synthesis of poly(ω-pentadecalactone-co-butylene-co-carbonate).

    PubMed

    Jiang, Zhaozhong

    2011-05-01

    Candida antarctica lipase B (CALB) was successfully used to promote synthesis of aliphatic poly(carbonate-co-ester) copolymers from dialkyl carbonate, diol, and lactone monomers. The polymerization reactions were carried out in two stages: first-stage oligomerization under low vacuum, followed by second-stage polymerization under high vacuum. Therefore, copolymerization of ω-pentadecalactone (PDL), diethyl carbonate (DEC), and 1,4-butanediol (BD) yielded PDL-DEC-BD copolymers with a M(w) of whole product (nonfractionated) up to 33 000 and M(w)/M(n) between 1.2 and 2.3. Desirable reaction temperature for the copolymerization was found to be ∼80 °C. The copolymer compositions, in the range from 10 to 80 mol % PDL unit content versus total (PDL + carbonate) units, were effectively controlled by adjusting the monomer feed ratio. Reprecipitation in chloroform/methanol mixture allowed isolation of the purified copolymers in up to 92% yield. (1)H and (13)C NMR analyses, including statistical analysis on repeat unit sequence distribution, were used to determine the polymer microstructures. The synthesized PDL-DEC-BD copolymers possessed near random structures with all possible combinations of PDL, carbonate, and butylene units via either ester or carbonate linkages in the polymer chains and are more appropriately named as poly(PDL-co-butylene-co-carbonate).

  4. Chemistry Rocks: Redox Chemistry as a Geologic Tool.

    ERIC Educational Resources Information Center

    Burns, Mary Sue

    2001-01-01

    Applies chemistry to earth science, uses rocks in chemistry laboratories, and teaches about transition metal chemistry, oxidation states, and oxidation-reduction reactions from firsthand experiences. (YDS)

  5. Constitutional dynamic chemistry: bridge from supramolecular chemistry to adaptive chemistry.

    PubMed

    Lehn, Jean-Marie

    2012-01-01

    Supramolecular chemistry aims at implementing highly complex chemical systems from molecular components held together by non-covalent intermolecular forces and effecting molecular recognition, catalysis and transport processes. A further step consists in the investigation of chemical systems undergoing self-organization, i.e. systems capable of spontaneously generating well-defined functional supramolecular architectures by self-assembly from their components, thus behaving as programmed chemical systems. Supramolecular chemistry is intrinsically a dynamic chemistry in view of the lability of the interactions connecting the molecular components of a supramolecular entity and the resulting ability of supramolecular species to exchange their constituents. The same holds for molecular chemistry when the molecular entity contains covalent bonds that may form and break reversibility, so as to allow a continuous change in constitution by reorganization and exchange of building blocks. These features define a Constitutional Dynamic Chemistry (CDC) on both the molecular and supramolecular levels.CDC introduces a paradigm shift with respect to constitutionally static chemistry. The latter relies on design for the generation of a target entity, whereas CDC takes advantage of dynamic diversity to allow variation and selection. The implementation of selection in chemistry introduces a fundamental change in outlook. Whereas self-organization by design strives to achieve full control over the output molecular or supramolecular entity by explicit programming, self-organization with selection operates on dynamic constitutional diversity in response to either internal or external factors to achieve adaptation.The merging of the features: -information and programmability, -dynamics and reversibility, -constitution and structural diversity, points to the emergence of adaptive and evolutive chemistry, towards a chemistry of complex matter.

  6. Special Report: Brain Chemistry.

    ERIC Educational Resources Information Center

    Krassner, Michael B.

    1983-01-01

    Chemical actions in the brain result in cognitive, emotional, neuroendocrine, neuromuscular, and/or neurocirculatory effects. Developments in understanding brain chemistry are discussed, considering among others, neurotransmitter chemistry, neuropeptides, drugs and the brain, antidepressants, and actions of minor tranquilizers. (JN)

  7. Organometallic Chemistry of Molybdenum.

    ERIC Educational Resources Information Center

    Lucas, C. Robert; Walsh, Kelly A.

    1987-01-01

    Suggests ways to avoid some of the problems students have learning the principles of organometallic chemistry. Provides a description of an experiment used in a third-year college chemistry laboratory on molybdenum. (TW)

  8. Chemistry for Potters.

    ERIC Educational Resources Information Center

    Denio, Allen A.

    1980-01-01

    Relates pottery making to chemistry by providing chemical information about clay, its origin, composition, properties, and changes that occur during firing; also describes glaze compositions, examples of redox chemistry, salt glazing, crystalline glazes, and problems in toxicity. (CS)

  9. Environmental chemistry: Volume A

    SciTech Connect

    Yen, T.F.

    1999-08-01

    This is an extensive introduction to environmental chemistry for engineering and chemical professionals. The contents of Volume A include a brief review of basic chemistry prior to coverage of litho, atmo, hydro, pedo, and biospheres.

  10. Chemistry as General Education

    ERIC Educational Resources Information Center

    Tro, Nivaldo J.

    2004-01-01

    The efficacy of different science and chemistry courses for science-major and non-major students, and the question of chemistry's contribution to general education are evaluated. Chemistry and science curriculum are too profession- and consumer-oriented, and to overcome this problem, it is advised that all disciplines must incorporate the major…

  11. History of Chemistry.

    ERIC Educational Resources Information Center

    Servos, John W.

    1985-01-01

    Discusses the development of chemistry in the United States by considering: (1) chemistry as an evolving body of ideas/techniques, and as a set of conceptual resources affecting and affected by the development of other sciences; and (2) chemistry related to the history of American social and economic institutions and practices. (JN)

  12. Chemistry and Art.

    ERIC Educational Resources Information Center

    Berry, Martyn

    1999-01-01

    Describes a Chemistry and Art project developed for secondary students and teachers sponsored by the National Gallery and The Royal Society of Chemistry in the United Kingdom. Discusses aspects of the techniques used in creating five paintings as well as the chemistry involved in their making, deterioration, conservation, and restoration.…

  13. Environmental Chemistry Activities.

    ERIC Educational Resources Information Center

    Jackland, Thomas; And Others

    The authors of this curriculum supplement believe in a laboratory approach to chemistry and express the feeling that environmental chemistry provides the students an opportunity to apply theoretical chemistry to important practical problems. There are eighteen activities presented, each accompanied with behavioral objectives, one or more suggested…

  14. Chemistry on Stamps.

    ERIC Educational Resources Information Center

    Schreck, James O.

    1986-01-01

    Suggests how postage stamps can be incorporated into chemistry teaching. Categories considered include emergence of chemistry as a science, metric system, atoms (and molecules and ions), stoichiometry, energy relationships in chemical systems, chemical bonding, nuclear chemistry, biochemistry, geochemistry, matter (gases, liquids, and solids),…

  15. Green Chemistry and Education.

    ERIC Educational Resources Information Center

    Hjeresen, Dennis L.; Schutt, David L.; Boese, Janet M.

    2000-01-01

    Many students today are profoundly interested in the sustainability of their world. Introduces Green Chemistry and its principles with teaching materials. Green Chemistry is the use of chemistry for pollution prevention and the design of chemical products and processes that are environmentally benign. (ASK)

  16. Mechanisms in Photographic Chemistry

    ERIC Educational Resources Information Center

    Sahyun, M. R. V.

    1974-01-01

    Reviews current research interests in photographic chemistry, involving two proposed models for spectral sensitization of crystal defects and impurities in the photolysis reactivity and the mechanisms of development and complexation. Establishment of photographic chemistry in a chemistry curriculum is recommended. (CC)

  17. School Chemistry vs. Chemistry in Research: An Exploratory Experiment.

    ERIC Educational Resources Information Center

    Habraken, Clarisse L.; Buijs, Wim; Borkent, Hens; Ligeon, Willy; Wender, Harry; Meijer, Marijn

    2001-01-01

    Reports on a study exploring why students are not studying chemistry. Three groups of graduating high school students and their chemistry teachers stayed at a research institute working on molecular modeling and wrote essays on school chemistry versus chemistry in research. Concludes that school chemistry does not convey today's chemistry in…

  18. 3D-QSAR Study of 7,8-Dialkyl-1,3-diaminopyrrolo-[3,2-f] Quinazolines with Anticancer Activity as DHFR Inhibitors

    NASA Astrophysics Data System (ADS)

    Chen, Jin-can; Chen, Lan-mei; Liao, Si-yan; Qian, Li; Zheng, Kang-cheng

    2009-06-01

    A three-dimensional quantitative structure-activity relationship (3D-QSAR) study of a series of 7,8-dialkyl-1,3-diaminopyrrolo-[3,2-f] quinazolines with anticancer activity as dihydrofolate reductase (DHFR) inhibitors was carried out by using the comparative molecular field analysis (CoMFA), on the basis of our reported 2D-QSAR of these compounds. The established 3D-QSAR model has good quality of statistics and good prediction ability; the non cross-validation correlation coefficient and the cross-validation value of this model are 0.993 and 0.619, respectively, the F value is 193.4, and the standard deviation SD is 0.208. This model indicates that the steric field factor plays a much more important role than the electrostatic one, in satisfying agreement with the published 2D-QSAR model. However, the 3D-QSAR model offers visual images of the steric field and the electrostatic field. The 3D-QSAR study further suggests the following: to improve the activity, the substituent R' should be selected to be a group with an adaptive bulk like Et or i-Pr, and the substituent R should be selected to be a larger alkyl. In particular, based on our present 3D-QSAR as well as the published 2D-QSAR, the experimentally-proposed hydrophobic binding mechanism on the receptor-binding site of the DHFR can be further explained in theory. Therefore, the QSAR studies help to further understand the “hydrophobic binding" action mechanism of this kind of compounds, and to direct the molecular design of new drugs with higher activity.

  19. Seasonal changes in glycerol dialkyl glycerol tetraether concentrations and fluxes in a perialpine lake: Implications for the use of the TEX 86 and BIT proxies

    NASA Astrophysics Data System (ADS)

    Blaga, Cornelia I.; Reichart, Gert-Jan; Vissers, Elisabeth W.; Lotter, André F.; Anselmetti, Flavio S.; Sinninghe Damsté, Jaap S.

    2011-11-01

    To determine where and when glycerol dialkyl glycerol tetraether (GDGT) membrane lipids in lakes are produced, we collected descending particles in Lake Lucerne (Switzerland) using two sediment traps (at 42 and 72 m water depth) with a monthly resolution from January 2008 to late March 2009. Suspended particulate matter (SPM) was monthly filtered from the water column at three different depths. The potential application of GDGTs in palaeoenvironmental and palaeoclimatic reconstructions was investigated by comparing core lipids and their relative GDGT distribution, with lake water temperatures throughout the year. Fluxes of GDGTs and their concentrations in the water column vary according to a seasonal pattern, showing a similar trend in the SPM and sediment traps. Fluxes and concentrations of isoprenoid GDGTs increase with depth, maximum values being observed in the deeper part of the water column, indicating production of isoprenoid GDGTs by Thaumarchaeota in the deep (˜50 m), aphotic zone of Lake Lucerne. The flux-weighted averages of the proxies TEX 86 (0.27) and BIT (0.03) based on the total extracted GDGTs are similar at both trap depths. A sediment core from the same location showed that in the first few centimetres of the core TEX 86 and BIT values of 0.29 and 0.07, respectively, are similar to those recorded for descending particles and SPM, indicating that the sedimentary TEX 86 records the annual mean temperature of deeper waters in Lake Lucerne. TEX 86 values are slightly higher below 20 cm in the core. This offset is interpreted to be caused by the present-day trophic state of the lake, which probably resulted in a deeper niche of the Thaumarchaeota. Branched GDGTs represent only a minor fraction of the total GDGTs in the lake and their origin remains unclear. Our data reveal that GDGTs in lakes have a large potential for palaeoclimatic studies but indicate that knowledge of the system is important for accurate interpretation.

  20. Constitutive Expression of the Cytochrome P450 EthABCD Monooxygenase System Enables Degradation of Synthetic Dialkyl Ethers in Aquincola tertiaricarbonis L108

    PubMed Central

    Schuster, Judith; Purswani, Jessica; Breuer, Uta; Pozo, Clementina; Harms, Hauke; Müller, Roland H.

    2013-01-01

    In Rhodococcus ruber IFP 2001, Rhodococcus zopfii IFP 2005, and Gordonia sp. strain IFP 2009, the cytochrome P450 monooxygenase EthABCD catalyzes hydroxylation of methoxy and ethoxy residues in the fuel oxygenates methyl tert-butyl ether (MTBE), ethyl tert-butyl ether (ETBE), and tert-amyl methyl ether (TAME). The expression of the IS3-type transposase-flanked eth genes is ETBE dependent and controlled by the regulator EthR (C. Malandain et al., FEMS Microbiol. Ecol. 72:289–296, 2010). In contrast, we demonstrated by reverse transcription-quantitative PCR (RT-qPCR) that the betaproteobacterium Aquincola tertiaricarbonis L108, which possesses the ethABCD genes but lacks ethR, constitutively expresses the P450 system at high levels even when growing on nonether substrates, such as glucose. The mutant strain A. tertiaricarbonis L10, which is unable to degrade dialkyl ethers, resulted from a transposition event mediated by a rolling-circle IS91-type element flanking the eth gene cluster in the wild-type strain L108. The constitutive expression of Eth monooxygenase is likely initiated by the housekeeping sigma factor σ70, as indicated by the presence in strain L108 of characteristic −10 and −35 binding sites upstream of ethA which are lacking in strain IFP 2001. This enables efficient degradation of diethyl ether, diisopropyl ether, MTBE, ETBE, TAME, and tert-amyl ethyl ether (TAEE) without any lag phase in strain L108. However, ethers with larger residues, n-hexyl methyl ether, tetrahydrofuran, and alkyl aryl ethers, were not attacked by the Eth system at significant rates in resting-cell experiments, indicating that the residue in the ether molecule which is not hydroxylated also contributes to the determination of substrate specificity. PMID:23354715

  1. Biological Sources of Branched Glycerol Dialkyl Glycerol Tetraethers (brGDGTs) in Terrestrial Hot Springs: A Possible Link Between Nitrogen-cycling Bacteria and brGDGT Production

    NASA Astrophysics Data System (ADS)

    Wang, J. X.; Xie, W.; Boyd, E. S.; Hedlund, B. P.; Zhang, C.

    2014-12-01

    Branched glycerol dialkyl glycerol tetraethers (brGDGTs) are common in peat, soil, lakes, rivers and hot springs. To seek the potential biological sources of brGDGTs in geothermal environments, we investigated 65 hot springs in the Yellowstone National Park (USA) and Tengchong (China). Together with previously published data from hot springs in the Great Basin (USA) and Tibet (China), we found that the abundance of brGDGTs tended to peak in springs with pH > 8. This contrasts with previous observations indicating an abundance of brGDGTs in acidic soils and peat bogs, suggesting a different biological source and function for lipids in these environments. In support of this hypothesis, a comparison of Cyclization ratios of Branched Tetraethers (CBT) between hot springs and surrounding soils indicated that more brGDGTs with cyclopentane moieties were produced in alkaline hot springs than in nearby low-temperature soils. Since Acidobacteria (the likely source of brGDGTs in peat bog environments) tend to have low CBT ratios, these data suggest a different source for brGDGTs in hot spring environments. RDA and regression analysis integrating brGDGT compounds and nitrogen species indicate that Bacteria involved in the nitrogen biogeochemical cycle (ammonia oxidation and nitrite reduction) may be related to the production of brGDGTs in terrestrial hot springs. However, direct evidence showing the link between nitrogen-cycling bacteria and brGDGT production has yet to be demonstrated under laboratory conditions. Nevertheless, our study expands the possibility of brGDGT sources into bacterial communities in terrestrial geothermal systems where Acidobacteria are absent or only a minor component.

  2. Insights into the biological source and environmental gradients shaping the distribution of H-shaped glycerol dialkyl glycerol tetraethers in Yellowstone National Park geothermal springs

    NASA Astrophysics Data System (ADS)

    Jia, C.; Xie, W.; Wang, J.; Boyd, E. S.; Zhang, C.

    2013-12-01

    Archaea are ubiquitous in natural environments. The unique tetraether lipids in archaeal membranes enable the maintenance of ion permeability across broad environmental gradients. H-shaped isoprenoid glycerol dialkyl glycerol tetraethers (H-GDGTs), in which the two biphytanyl carbon skeletons are covalently bound by a carbon-carbon bond, have been recently identified in both marine and geothermal environments. Here we report the core H-GDGTs (C-H-GDGTs) and polar H-GDGTs (P-H-GDGTs) associated with sediments sampled from geothermal springs in Yellowstone National Park and investigate their abundance in relation to environmental gradients. The abundance of C- and P-H-GDGTs exhibit strong and negative correlation with pH (P = 0.007), suggesting that H-shaped GDGTs help to maintain cell membrane fluidity in acidic environments. Reanalysis of archaeal 16S rRNA gene pyrotags published previously from (Boyd E. Hamilton T. L., Wang J., He L., Zhang C. L. 2013. The role of tetraether lipid composition in the adaptation of thermophilic archaea to acidity. Frontiers in Terrestrial Microbiology. 4: doi: 10.3389/fmicb.2013.00062) indicates that these H-GDGTs are associated with environments dominanted by Thermoplasmatales, which are thermoacidiphiles. Two equations were established to define the relationships between the abundance of H-GDGTs, the abundance of archaeal taxa based on 16S rRNA gene phylogenetic affiliations, and pH. Both equations have high predictive capacity in predicting the distribution of archaeal lipids in the geothermal system. These observations provide new insight into the biological source of H-GDGTs and suggest a prominent role for these lipids in the diversification of archaea into or out of acidic high temperature environments.

  3. Distribution of branched glycerol dialkyl glycerol tetraethers in surface soils of the Qinghai-Tibetan Plateau: implications of brGDGTs-based proxies in cold and dry regions

    NASA Astrophysics Data System (ADS)

    Ding, S.; Xu, Y.; Wang, Y.; He, Y.; Hou, J.; Chen, L.; He, J.-S.

    2015-06-01

    The methylation index of branched tetraethers (MBT) and cyclization ratio of branched tetraethers (CBT) based on the distribution of branched glycerol dialkyl glycerol tetraethers (brGDGT) are useful proxies for the reconstruction of mean annual air temperature (MAT) and soil pH. Recently, a series of 6-methyl brGDGTs were identified which were previously co-eluted with 5-methyl brGDGTs. However, little is known about 6-methyl brGDGTs in the Qinghai-Tibetan Plateau (QTP), a critical region of the global climate system. Here, we analyze 30 surface soils covering a large area of the QTP, among which 6-methyl brGDGTs were the most abundant components (average 53 ± 17% of total brGDGT). The fractional abundance of 6-methyl brGDGTs showed a good correlation with soil pH, while the global MBT'5ME calibration overestimates MAT in the QTP. We therefore proposed a MBT5/6 index including both 5- and 6-methyl brGDGTs, presenting a strong correlation with MAT in QTP: MAT = -20.14 + 39.51 × MBT5/6 (n = 27, r2 = 0.82; RMSE = 1.3 °C). Another index, namely IBT (isomerization of branched tetraether), based on carbon skeleton isomerization of the 5-methyl to 6-methyl brGDGTs, is dependent on soil pH: pH = 6.77 - 1.56 × IBT (n = 27; r2 = 0.74, RMSE = 0.32). Our study suggests that changing the position of methyl group of brGDGTs may be another mechanism for some soil bacteria to adapt to the ambient pH change in addition to the well-known cyclization.

  4. Evaluating Spatial Heterogeneity and Environmental Variability Inferred from Branched Glycerol Dialkyl Glycerol Tetraethers (GDGTs) Distribution in Soils from Valles Caldera, New Mexic

    NASA Astrophysics Data System (ADS)

    Contreras Quintana, S. H.; Werne, J. P.; Brown, E. T.; Halbur, J.; Sinninghe Damsté, , J.; Schouten, S.; Correa-Metrio, A.; Fawcett, P. J.

    2014-12-01

    Branched glycerol dialkyl glycerol tetraethers (GDGTs) are recently discovered bacterial membrane lipids, ubiquitously present in peat bogs and soils, as well as in rivers, lakes and lake sediments. Their distribution appears to be controlled mainly by soil pH and annual mean air temperature (MAT) and they have been increasingly used as paleoclimate proxies in sedimentary records. In order to validate their application as paleoclimate proxies, it is essential evaluate the influence of small scale environmental variability on their distribution. Initial application of the original soil-based branched GDGT distribution proxy to lacustrine sediments from Valles Caldera, New Mexico (NM) was promising, producing a viable temperature record spanning two glacial/interglacial cycles. In this study, we assess the influence of analytical and spatial soil heterogeneity on the concentration and distribution of 9 branched GDGTs in soils from Valles Caldera, and show how this variability is propagated to MAT and pH estimates using multiple soil-based branched GDGT transfer functions. Our results show that significant differences in the abundance and distribution of branched GDGTs in soil can be observed even within a small area such as Valles Caldera. Although the original MBT-CBT calibration appears to give robust MAT estimates and the newest calibration provides pH estimates in better agreement with modern local soils in Valles Caldera, the environmental heterogeneity (e.g. vegetation type and soil moisture) appears to affect the precision of MAT and pH estimates. Furthermore, the heterogeneity of soils leads to significant variability among samples taken even from within a square meter. While such soil heterogeneity is not unknown (and is typically controlled for by combining multiple samples), this study quantifies heterogeneity relative to branched GDGT-based proxies for the first time, indicating that care must be taken with samples from heterogeneous soils in MAT and p

  5. Connecting Algebra and Chemistry.

    ERIC Educational Resources Information Center

    O'Connor, Sean

    2003-01-01

    Correlates high school chemistry curriculum with high school algebra curriculum and makes the case for an integrated approach to mathematics and science instruction. Focuses on process integration. (DDR)

  6. Science Update: Analytical Chemistry.

    ERIC Educational Resources Information Center

    Worthy, Ward

    1980-01-01

    Briefly discusses new instrumentation in the field of analytical chemistry. Advances in liquid chromatography, photoacoustic spectroscopy, the use of lasers, and mass spectrometry are also discussed. (CS)

  7. Distributions of glycerol dialkyl glycerol tetraethers in surface soils of Qinghai-Tibetan Plateau: implications of GDGT-based proxies in cold and dry regions

    NASA Astrophysics Data System (ADS)

    Ding, S.; Xu, Y.; Wang, Y.; He, Y.; Hou, J.; Chen, L.; He, J.-S.

    2015-01-01

    The methylation index of branched tetraethers (MBT) and cyclization ratio of branched tetraethers (CBT) based on the distribution of bacteria-derived branched glycerol dialkyl glycerol tetraethers (bGDGTs) are useful proxies for the reconstruction of continental paleotemperature and soil pH. Several calibrations of the MBT-CBT index have been proposed based on global and regional soils and lake sediments. However, little is known about the distribution and applicability of GDGTs proxies in the Qinghai-Tibet Plateau (QTP), a critical region of the global climate system. Here, we investigated 33 surface soils covering a large area of the QTP. Redundancy analysis showed that soil pH was the most important factor affecting GDGT distributions, followed by mean annual precipitation (MAP) and mean annual air temperature (MAT). The branched-isoprenoid tetraether (BIT) index, an indicator for estimation of soil organic matter in aquatic environments, varied from 0.48 to 1 and negatively correlated with soil pH (r2 = 0.38), suggesting that the BIT index should be used with caution in the QTP. A transfer function of the CBT index-soil pH was established to estimate paleo-soil pH in the QTP: pH = 8.33-1.43 × CBT (r2 = 0.80, RMSE = 0.27 pH unit). The local calibration of MBT-CBT index presented a weak, still significant correlation with MAT (r2 = 0.36) mainly owing to the additional influence of MAP (r2 = 0.50). Combining our data with previously reported GDGTs for Chinese soils resulted in a new calibration of MBT/CBT-MAT: MAT = 2.68+26.14 × MBT-3.37 × CBT (r2 = 0.73; RMSE = 4.2 °C, n = 164). The correlation coefficient and residual error of this new transfer function is comparable with global calibrations, suggesting that MBT-CBT paleotemperature proxy is still valid in the QTP.

  8. Provenance of tetraether membrane lipids in a large temperate lake (Loch Lomond, UK): implications for glycerol dialkyl glycerol tetraether (GDGT)-based palaeothermometry

    NASA Astrophysics Data System (ADS)

    Buckles, L. K.; Weijers, J. W. H.; Tran, X.-M.; Waldron, S.; Sinninghe Damsté, J. S.

    2014-10-01

    The application of glycerol dialkyl glycerol tetraether (GDGT)-based palaeoenvironmental proxies, such as the branched vs. isoprenoidal tetratether (BIT) index, TEX86 and the MBT-CBT palaeothermometer, has lately been expanded to lacustrine sediments. Given recent research identifying the production of branched, bacterial GDGTs (brGDGTs) within lakes, it is necessary to ascertain the effect of this lacustrine production on GDGT-based proxies. This study profiles a temperate, monomictic lake (Loch Lomond, UK), analysing labile intact polar GDGT lipids (IPLs) and resilient core GDGT lipids (CLs) in catchment soils, small tributary rivers, lake water and lake sediments. Loch Lomond consists of two basins bisected by the Highland Boundary Fault, resulting in a mesotrophic to oligotrophic gradient from south to north. The north basin is fjord-like, while the south basin is shallow with a lowland catchment. Besides abundant influxes of allochthonous soil- and peat-derived (CL) brGDGTs, brGDGTs are produced in a variety of settings in Loch Lomond. Rather than integrating a scattered soil signal, there is some evidence that small rivers may contribute to the brGDGT pool through addition of brGDGTs produced in situ in these streams. Three hundred days of settling particles and water column profiles of suspended particulate matter (SPM; March and September 2011) reveal brGDGT production throughout the water column, with (IPL and CL) brGDGT distributions varying by basin. In lake sediments, in situ brGDGT production affects the distributions of sedimentary brGDGTs despite high soil- and peat-derived organic matter influxes from the catchment. MBT-CBT-derived mean annual air temperature (MAAT) estimates from soil, river and lake sediments vary widely. A strong bias towards higher MAATs in the south and lower MAATs in the north basin further complicates the application of the proxy. These results emphasise that caution must be exercised when applying the MBT

  9. Use of Branched Glycerol Dialkyl Glycerol Tetraethers and the MBT/CBT Proxy: a Paleothermometer for the Islands of Hawaii and Oahu

    NASA Astrophysics Data System (ADS)

    Jenzen, E. T.; Fang, J.; Field, D. B.

    2012-12-01

    Branched glycerol dialkyl glycerol tetraethers (GDGTs), produced by a yet unknown phyla of bacteria, have previously been found to be ubiquitous within soils. Through quantification of abundance of 4 varying types of GDGTs within a soil sample, the methylation of branched tetraethers (MBT) and the cyclization of branched tetraethers (CBT) can be determined. While prior researchers have deduced that CBT closely correlates to paleo-pH of soil and the MBT proxy corresponds to both paleo-temperature and paleo-pH of soils, it has been explicitly and unanimously stated that local calibrations are necessary for application of the MBT/CBT proxy to be viable. Additionally, there is very limited terrestrial paleo-temperature data for the Pacific subtropical gyre. In order to develop a calibrated MBT/CBT proxy for Hawaii, 8 sites of varying elevation (800-1600m a.s.l.) along the Laupahoehoe region of Mauna Kea as well as a diversity of sites around the island of Oahu were chosen and samples of the soil-surface were taken. Sites around Oahu include both the windward and leeward side, accounting for the orographic effect, as well as sites of varying elevations. Analysis and quantification was done using liquid chromatography-mass spectrometry (LC-MS). Preliminary results have thus far confirmed the hypothesized outcome that temperature and pH do in fact have a direct affect on the abundance of GDGTs in Hawaiian surface-soils. Although consistent with previous research in that abundance of GDGTs is linked to both temperature and pH, the results show that effectiveness of the MBT proxy at finding minute changes in temperature in Hawaii is limited, (as previous research has been conducted mainly on higher latitude soils with more variant temperature distributions). Therefore, it is pertinent to use the calibration for mainly larger scale temperature changes. Results of the calibration are currently being applied down-core to detect temperature changes during the last glacial

  10. Opportunities in Chemistry.

    ERIC Educational Resources Information Center

    National Academy of Sciences - National Research Council, Washington, DC.

    Because of the changes occurring in the chemical sciences, a new survey of chemistry and its intellectual and economic impact was clearly needed. This report presents a current assessment of the status of chemistry and of the future opportunities in the field. This analysis contains: (1) an introductory chapter (establishing the need for the…

  11. Coupled Phenomena in Chemistry.

    ERIC Educational Resources Information Center

    Matsubara, Akira; Nomura, Kazuo

    1979-01-01

    Various phenomena in chemistry and biology can be understood through Gibbs energy utilization. Some common phenomena in chemistry are explained including neutralization, hydrolysis, oxidation and reaction, simultaneous dissociation equilibrium of two weak acids, and common ion effect on solubility. (Author/SA)

  12. Undergraduate Chemistry Laboratory

    ERIC Educational Resources Information Center

    Bretz, Stacey Lowery; Fay, Michael; Bruck, Laura B.; Towns, Marcy H.

    2013-01-01

    Forty chemistry faculty from American Chemical Society-approved departments were interviewed to determine their goals for undergraduate chemistry laboratory. Faculty were stratified by type of institution, departmental success with regard to National Science Foundation funding for laboratory reform, and level of laboratory course. Interview…

  13. Brushing Up on Chemistry.

    ERIC Educational Resources Information Center

    Trantow, Ashley

    2002-01-01

    Presents an activity designed for use during National Chemistry Week 2002 with the theme "Chemistry Keeps Us Clean". Allows students to discover more about a cleaning product they use everyday. Students make their own toothpaste and compare its properties with those of commercial toothpaste. (MM)

  14. Minicourses in Chemistry

    ERIC Educational Resources Information Center

    Lygre, D. G.; And Others

    1975-01-01

    Describes nine minicourses in chemistry designed to acquaint the non-science major with practical applications of chemistry in everyday experiences. Each course consists of daily classes for two weeks for one credit and is offered on a credit/no credit basis. (MLH)

  15. Chemistry of Moth Repellents

    ERIC Educational Resources Information Center

    Pinto, Gabriel

    2005-01-01

    An effective way to teach chemistry is to examine the substances used in daily life from a pedagogical viewpoint, from the overlap of science, technology, and society (STS). A study aims to engage students in the topic of moth repellents and to encourage them to investigate the chemistry in this familiar product using a set of questions.

  16. Chemistry and Biology

    ERIC Educational Resources Information Center

    Wigston, David L.

    1970-01-01

    Discusses the relationship between chemisty and biology in the science curriculum. Points out the differences in perception of the disciplines, which the physical scientists favoring reductionism. Suggests that biology departments offer a special course for chemistry students, just as the chemistry departments have done for biology students.…

  17. Chemistry from Issues.

    ERIC Educational Resources Information Center

    Harding, Jan; Donaldson, Jim

    1986-01-01

    Describes the "Chemistry from Issues" project at Chelsea College. Provides the background information, rationale, and overall structure of a proposed course about the importance of chemistry to common culture. Outlines one module about the British steel industry that has been taught at King's College. (TW)

  18. Chemistry in Microfluidic Channels

    ERIC Educational Resources Information Center

    Chia, Matthew C.; Sweeney, Christina M.; Odom, Teri W.

    2011-01-01

    General chemistry introduces principles such as acid-base chemistry, mixing, and precipitation that are usually demonstrated in bulk solutions. In this laboratory experiment, we describe how chemical reactions can be performed in a microfluidic channel to show advanced concepts such as laminar fluid flow and controlled precipitation. Three sets of…

  19. Stratospheric chemistry and transport

    NASA Technical Reports Server (NTRS)

    Prather, Michael; Garcia, Maria M.

    1990-01-01

    A Chemical Tracer Model (CTM) that can use wind field data generated by the General Circulation Model (GCM) is developed to implement chemistry in the three dimensional GCM of the middle atmosphere. Initially, chemical tracers with simple first order losses such as N2O are used. Successive models are to incorporate more complex ozone chemistry.

  20. Career Options in Chemistry.

    ERIC Educational Resources Information Center

    Belloli, Robert C.

    1985-01-01

    Describes a credit/no credit course which focuses on career options in chemistry. The course (consisting of 15 one-hour seminar-type sessions) includes guest speakers for several sessions and an emphasis (in introductory sessions) on graduate school in chemistry, the chemical industry, resumes, and interviews. Also briefly describes an internship…

  1. Movies in Chemistry Education

    ERIC Educational Resources Information Center

    Pekdag, Bulent; Le Marechal, Jean-Francois

    2010-01-01

    This article reviews numerous studies on chemistry movies. Movies, or moving pictures, are important elements of multimedia and signify a privileged or motivating means of presenting knowledge. Studies on chemistry movies show that the first movie productions in this field were devoted to university lectures or documentaries. Shorter movies were…

  2. Infrared Lasers in Chemistry.

    ERIC Educational Resources Information Center

    John, Phillip

    1982-01-01

    Selected infrared laser chemistry topics are discussed including carbon dioxide lasers, infrared quanta and molecules, laser-induced chemistry, structural isomerization (laser purification, sensitized reactions, and dielectric breakdown), and fundamental principles of laser isotope separation, focusing on uranium isotope separation. (JN)

  3. Art in Chemistry; Chemistry in Art.

    ERIC Educational Resources Information Center

    Greenberg, Barbara R.; Patterson, Dianne

    High school teachers are often challenged to motivate students who have little or no interest in a subject and are bored with traditional instruction. This unique book is designed to help educators make chemistry classes more interesting and links art curriculum to practical applications, integrating the two subjects through scores of hands-on…

  4. Korean Kimchi Chemistry: A Multicultural Chemistry Connection

    ERIC Educational Resources Information Center

    Murfin, Brian

    2009-01-01

    Connecting science with different cultures is one way to interest students in science, to relate science to their lives, and at the same time to broaden their horizons in a variety of ways. In the lesson described here, students make kimchi, a delicious and popular Korean dish that can be used to explore many important chemistry concepts,…

  5. EVOLVING FROM GREEN CHEMISTRY TO SUSTAINABLE CHEMISTRY

    EPA Science Inventory

    The twelve principles of green chemistry provide a foundation and pathway which allows researchers to incorporate greenness into existing reactions or when developing new technologies. Research from our laboratory has adopted many of these principles and utlizes them as a major c...

  6. Moderator Chemistry Program

    SciTech Connect

    Dewitt, L.V.; Gibbs, A.; Lambert, D.P.; Bohrer, S.R.; Fanning, R.L.; Houston, M.W.; Stinson, S.L.; Deible, R.W.; Abdel-Khalik, S.I.

    1990-11-01

    Over the past fifteen months, the Systems Chemistry Group of the Reactor Engineering Department has undertaken a comprehensive study of the Department`s moderator chemistry program at Savannah River Site (SRS). An internal review was developed to formalize and document this program. Objectives were as outlined in a mission statement and action plan. In addition to the mission statement and action plan, nine separate task reports have been issued during the course of this study. Each of these task reports is included in this document as a chapter. This document is an organized compilation of the individual reports issued by the Systems Chemistry Group in assessment of SRS moderator chemistry to determine if there were significant gaps in the program as ft existed in October, 1989. While these reviews found no significant gaps in that mode of operation, or any items that adversely affected safety, items were identified that could be improved. Many of the items have already been dear with or are in the process of completion under this Moderator Chemistry Program and other Reactor Restart programs. A complete list of the items of improvement found under this assessment is found in Chapter 9, along with a proposed time table for correcting remaining items that can be improved for the chemistry program of SRS reactors. An additional external review of the moderator chemistry processes, recommendations, and responses to/from the Reactor Corrosion Mitigation Committee is included as Appendix to this compilation.

  7. Moderator Chemistry Program

    SciTech Connect

    Dewitt, L.V.; Gibbs, A.; Lambert, D.P.; Bohrer, S.R.; Fanning, R.L.; Houston, M.W.; Stinson, S.L.; Deible, R.W.; Abdel-Khalik, S.I.

    1990-11-01

    Over the past fifteen months, the Systems Chemistry Group of the Reactor Engineering Department has undertaken a comprehensive study of the Department's moderator chemistry program at Savannah River Site (SRS). An internal review was developed to formalize and document this program. Objectives were as outlined in a mission statement and action plan. In addition to the mission statement and action plan, nine separate task reports have been issued during the course of this study. Each of these task reports is included in this document as a chapter. This document is an organized compilation of the individual reports issued by the Systems Chemistry Group in assessment of SRS moderator chemistry to determine if there were significant gaps in the program as ft existed in October, 1989. While these reviews found no significant gaps in that mode of operation, or any items that adversely affected safety, items were identified that could be improved. Many of the items have already been dear with or are in the process of completion under this Moderator Chemistry Program and other Reactor Restart programs. A complete list of the items of improvement found under this assessment is found in Chapter 9, along with a proposed time table for correcting remaining items that can be improved for the chemistry program of SRS reactors. An additional external review of the moderator chemistry processes, recommendations, and responses to/from the Reactor Corrosion Mitigation Committee is included as Appendix to this compilation.

  8. Fluorine in medicinal chemistry.

    PubMed

    Swallow, Steven

    2015-01-01

    Since its first use in the steroid field in the late 1950s, the use of fluorine in medicinal chemistry has become commonplace, with the small electronegative fluorine atom being a key part of the medicinal chemist's repertoire of substitutions used to modulate all aspects of molecular properties including potency, physical chemistry and pharmacokinetics. This review will highlight the special nature of fluorine, drawing from a survey of marketed fluorinated pharmaceuticals and the medicinal chemistry literature, to illustrate key concepts exploited by medicinal chemists in their attempts to optimize drug molecules. Some of the potential pitfalls in the use of fluorine will also be highlighted.

  9. Frontiers in analytical chemistry

    SciTech Connect

    Amato, I.

    1988-12-15

    Doing more with less was the modus operandi of R. Buckminster Fuller, the late science genius, and inventor of such things as the geodesic dome. In late September, chemists described their own version of this maxim--learning more chemistry from less material and in less time--in a symposium titled Frontiers in Analytical Chemistry at the 196th National Meeting of the American Chemical Society in Los Angeles. Symposium organizer Allen J. Bard of the University of Texas at Austin assembled six speakers, himself among them, to survey pretty widely different areas of analytical chemistry.

  10. Computational quantum chemistry website

    SciTech Connect

    1997-08-22

    This report contains the contents of a web page related to research on the development of quantum chemistry methods for computational thermochemistry and the application of quantum chemistry methods to problems in material chemistry and chemical sciences. Research programs highlighted include: Gaussian-2 theory; Density functional theory; Molecular sieve materials; Diamond thin-film growth from buckyball precursors; Electronic structure calculations on lithium polymer electrolytes; Long-distance electronic coupling in donor/acceptor molecules; and Computational studies of NOx reactions in radioactive waste storage.

  11. Seawater Chemistry Package

    2005-11-23

    SeaChem Seawater Chemistry package provides routines to calculate pH, carbonate chemistry, density, and other quantities for seawater, based on the latest community standards. The chemistry is adapted from fortran routines provided by the OCMIP3/NOCES project, details of which are available at http://www.ipsl.jussieu.fr/OCMIP/. The SeaChem package can generate Fortran subroutines as well as Python wrappers for those routines. Thus the same code can be used by Python or Fortran analysis packages and Fortran ocean models alike.

  12. A recyclable heavy fluorous tag carrying an allyl alcohol pendant group: design and evaluation toward applications in synthetic carbohydrate chemistry.

    PubMed

    Fukuda, Kazuo; Tojino, Mami; Goto, Kohtaro; Dohi, Hirofumi; Nishida, Yoshihiro; Mizuno, Mamoru

    2015-04-30

    Toward applications in synthetic carbohydrate chemistry, we converted our previous acid-resistant heavy fluorous tag [(Rf)3C-CH2-OH, 1] to allyl alcohol derivatives [(Rf)3C-CH2-O-(CH2)n-CH=CH-CH2-OH, 3 (n=1) or 4 (n=3)] by means of olefin cross metathesis. They were then subjected to β-glycosylation reactions by using a series of glycosyl donors, including glycosyl bromide and trichloroacetimidates. The terminal OH group in 3 and 4 was found to be β-glycosylated in moderate yield when 2,3,4,6-tetra-O-benzoyl-D-galactosyl trichloroacetimidate was used as the glycosyl donor. Upon a detachment reaction using Pd(PPh3)4, the initial heavy fluorous tag 1 was recovered in high yield (>90%) together with 1-hydroxy sugar, indicating that not only the allyl ether linkage in the glycosides but also the internal di-alkyl ether linkage in 4 be cleaved by the action of the Pd-catalyst enabling long-range olefin transmigration. Potential utility was demonstrated by using the tetra-O-benzoyl-β-D-galactosylated derivative of 3 in a series of deprotection, protection and glycosylation reactions, which were conductible in high yields without using chromatographic purification process. These findings prompt us to propose a general scheme in which the acid-resistant heavy fluorous compound 1 is applied as a recyclable tag in synthetic carbohydrate chemistry.

  13. General Chemistry for Engineers.

    ERIC Educational Resources Information Center

    Kybett, B. D.

    1982-01-01

    Discusses the relationship between molecular structure, intermolecular forces, and tensile strengths of a polymer and suggests that this is a logical way to introduce polymers into a general chemistry course. (Author/JN)

  14. Chemistry for Nonscientists

    ERIC Educational Resources Information Center

    Weil, Thomas A.; And Others

    1974-01-01

    Discusses the case of DDT which can be introduced to nonscience students in a chemistry course, including the development of DDT, problems associated with its adverse effects, and curtailment of its use in our environments. (CC)

  15. Chemistry for Kids.

    ERIC Educational Resources Information Center

    Sato, Sanae; Majoros, Bela

    1988-01-01

    Reports two methods for interesting children in chemistry. Describes a method for producing large soap bubbles and films for study. Examines the use of simple stories to explain common chemical concepts with example given. Lists titles of available stories. (ML)

  16. Chemistry with a Peel.

    ERIC Educational Resources Information Center

    Borer, Londa; Larsen, Eric

    1997-01-01

    Presents experiments that introduce natural product chemistry into high school classrooms. In the laboratory activities, students isolate and analyze the oil in orange peels. Students also perform a steam distillation and learn about terpenes. (DDR)

  17. Chemistry Laboratory Safety Check

    ERIC Educational Resources Information Center

    Patnoe, Richard L.

    1976-01-01

    An accident prevention/safety check list for chemistry laboratories is printed. Included are checks of equipment, facilities, storage and handling of chemicals, laboratory procedures, instruction procedures, and items to be excluded from chemical laboratories. (SL)

  18. Magnetism in Chemistry

    ERIC Educational Resources Information Center

    Brookes, R. W.; McFadyen, W. D.

    1975-01-01

    Discusses the technical aspects of paramagnetism and an electrostatic model called Crystal Field Theory (CFT), very often used in the case of transition metal compounds. Suggests that this discussion be included as an option for college chemistry courses. (MLH)

  19. Supplemental instruction in chemistry

    NASA Astrophysics Data System (ADS)

    Lundeberg, Mary A.

    This study was designed to measure some effects of supplemental instruction in chemistry. Supplemental instruction is a peer-led cooperative learning program that encourages students to develop conceptual understanding by articulating both understandings and misconceptions in a think-aloud fashion. Supplemental instruction was offered three hours weekly outside of class and lab time for students in four classes of General Organic and Biological Chemistry. Over a two-year period 108 students volunteered to participate in this program; 45 students did not participate. As measured by final grades in chemistry and responses to a questionnaire, supplemental instruction was effective in increasing students' achievement in chemistry. Further research is needed to determine the in-depth effects of supplemental instruction on students' learning, problem solving, and self-esteem.

  20. Chemistry and Detective Fiction.

    ERIC Educational Resources Information Center

    Labianca, Dominick A.; Reeves, William J.

    1981-01-01

    Describes an interdisciplinary program consisting of two courses. The first course deals with the chemistry of drugs and poisons; the second course focuses on fictional works in which these drugs and poisons are central to the plots. (SK)

  1. Water Chemistry: Seeking Information

    ERIC Educational Resources Information Center

    Delfino, Joseph J.

    1977-01-01

    A survey of the available literature in water chemistry is presented. Materials surveyed include: texts, reference books, bibliographic resources, journals, American Chemical Society publications, proceedings, unpublished articles, and reports. (BT)

  2. Enzymes in Analytical Chemistry.

    ERIC Educational Resources Information Center

    Fishman, Myer M.

    1980-01-01

    Presents tabular information concerning recent research in the field of enzymes in analytic chemistry, with methods, substrate or reaction catalyzed, assay, comments and references listed. The table refers to 128 references. Also listed are 13 general citations. (CS)

  3. EPA Environmental Chemistry Laboratory

    NASA Technical Reports Server (NTRS)

    1993-01-01

    The Environmental Protection Agency's (EPA) Chemistry Laboratory (ECL) is a national program laboratory specializing in residue chemistry analysis under the jurisdiction of the EPA's Office of Pesticide Programs in Washington, D.C. At Stennis Space Center, the laboratory's work supports many federal anti-pollution laws. The laboratory analyzes environmental and human samples to determine the presence and amount of agricultural chemicals and related substances. Pictured, ECL chemists analyze environmental and human samples for the presence of pesticides and other pollutants.

  4. Impact of surface chemistry

    PubMed Central

    Somorjai, Gabor A.; Li, Yimin

    2011-01-01

    The applications of molecular surface chemistry in heterogeneous catalyst technology, semiconductor-based technology, medical technology, anticorrosion and lubricant technology, and nanotechnology are highlighted in this perspective. The evolution of surface chemistry at the molecular level is reviewed, and the key roles of surface instrumentation developments for in situ studies of the gas–solid, liquid–solid, and solid–solid interfaces under reaction conditions are emphasized. PMID:20880833

  5. Design, microwave-mediated synthesis and biological evaluation of novel 4-aryl(alkyl)amino-3-nitroquinoline and 2,4-diaryl(dialkyl)amino-3-nitroquinolines as anticancer agents.

    PubMed

    Chauhan, Monika; Rana, Anil; Alex, Jimi Marin; Negi, Arvind; Singh, Sandeep; Kumar, Raj

    2015-02-01

    Design, microwave-assisted synthesis of novel 4-aryl (alkyl)amino-3-nitroquinoline (1a-1l) and 2,4-diaryl (dialkyl)amino-3-nitroquinolines (2a-2k and 3a) via regioselective and complete nucleophilic substitution of 2,4-dichloro-3-nitroquinoline, respectively in water are presented. The newly synthesized compounds were evaluated for the first time for antiproliferative activity against EGFR overexpressing human lung (A-549 and H-460) and colon (HCT-116-wild type and HCT-116-p53 null) cancer cell lines. Some notions about structure-activity relationships (SAR) are presented. Compounds 2e, 2f, 2j and 3a overall exhibited excellent anticancer activity comparable to erlotinib which was used as a positive control. Molecular modeling studies disclosed the recognition pattern of the compounds and also supported the observed SAR. PMID:25462621

  6. Synergistic effects in solvent-extraction systems based on alkylsalicylic acids. III. Extraction of the trivalent lanthanides and yttrium from chloride media in the presence of dialkyl and diaryl sulphoxides

    SciTech Connect

    Preston, J.S.; Preez, A.C. du

    1996-08-01

    Dialkyl and diaryl sulphoxides were found to cause synergistic shifts in the pH{sub 50} values for the extraction of the trivalent lanthanides and yttrium from sodium chloride media by solutions of alkylsalicylic acids in xylene. The extent of the synergistic shift for a given sulphoxide increases with increasing steric bulk of the alkylsalicylic acid used. With the homologous series of dialkyl sulphoxides R{sub 2}SO, where R = n-butyl, n-hexyl, and n-octyl, there is little variation in the size of the synergistic shift for a given alkylsalicylic acid. For a series of sulphoxides containing similar numbers of carbon atoms, the extent of the shift increases with the introduction of alicyclic rings, but decreases when aromatic rings are introduced, for example, in the order of R: cyclohexyl > n-hexyl > phenyl, although the effect is not very marked. For a given extractant mixture, the pH{sub 50} values decrease from lanthanum to samarium and then increase from samarium to lutetium. The separation between the pH{sub 50} values for lanthanum and lutetium increases with increasing steric bulk of both the alkylsalicylic acid (HA) and the sulphoxide (L), but the separations between adjacent lanthanides are in all cases too small to be of any practical use. Slope-analysis treatment of metal-distribution data, and measurements of the solubility of the neodymium-alkylsalicylic acid complex in xylene solutions of the sulphoxides are consistent with the extraction of a mixed-ligand complex of the type NdA{sub 3}L{sub 2}. 22 refs., 4 figs., 4 tabs.

  7. Residue chemistry guidelines.

    PubMed

    Olinger, C L; Schmitt, R D; Zager, E

    1993-01-01

    Residue chemistry guidelines are designed to determine what the potential residues in food are and how much may be present as a result of pesticide application, so that a tolerance level may be established. Some requirements are established to assist in the enforcement of tolerances by the USDA, FDA, and the states. I realize I have given you a quick overview of the residue chemistry requirements. There are many documents which are available if you should require more information, such as the Subdivision O Residue Chemistry Guidelines, Standard Evaluation Procedures (which are used by reviewers when evaluating the studies), the Data Reporting Guidelines (which provide guidance on preparing final reports), and the Technical Guidance from Phase III of Reregistration. We have also released various papers on studies when additional guidance is required. Most of these documents are available from NTIS. I hope you will consider this information when auditing residue chemistry studies. As I see the efforts that you, the QA professionals, have made to educate yourselves on residue chemistry studies through programs such as this meeting, I have a little more confidence in answering the question "Do you trust them?" with a "Yes." Thank you.

  8. Technetium Chemistry in HLW

    SciTech Connect

    Hess, Nancy J.; Felmy, Andrew R.; Rosso, Kevin M.; Xia Yuanxian

    2005-06-06

    Tc contamination is found within the DOE complex at those sites whose mission involved extraction of plutonium from irradiated uranium fuel or isotopic enrichment of uranium. At the Hanford Site, chemical separations and extraction processes generated large amounts of high level and transuranic wastes that are currently stored in underground tanks. The waste from these extraction processes is currently stored in underground High Level Waste (HLW) tanks. However, the chemistry of the HLW in any given tank is greatly complicated by repeated efforts to reduce volume and recover isotopes. These processes ultimately resulted in mixing of waste streams from different processes. As a result, the chemistry and the fate of Tc in HLW tanks are not well understood. This lack of understanding has been made evident in the failed efforts to leach Tc from sludge and to remove Tc from supernatants prior to immobilization. Although recent interest in Tc chemistry has shifted from pretreatment chemistry to waste residuals, both needs are served by a fundamental understanding of Tc chemistry.

  9. Collaborative Physical Chemistry Projects Involving Computational Chemistry

    NASA Astrophysics Data System (ADS)

    Whisnant, David M.; Howe, Jerry J.; Lever, Lisa S.

    2000-02-01

    The physical chemistry classes from three colleges have collaborated on two computational chemistry projects using Quantum CAChe 3.0 and Gaussian 94W running on Pentium II PCs. Online communication by email and the World Wide Web was an important part of the collaboration. In the first project, students used molecular modeling to predict benzene derivatives that might be possible hair dyes. They used PM3 and ZINDO calculations to predict the electronic spectra of the molecules and tested the predicted spectra by comparing some with experimental measurements. They also did literature searches for real hair dyes and possible health effects. In the final phase of the project they proposed a synthetic pathway for one compound. In the second project the students were asked to predict which isomer of a small carbon cluster (C3, C4, or C5) was responsible for a series of IR lines observed in the spectrum of a carbon star. After preliminary PM3 calculations, they used ab initio calculations at the HF/6-31G(d) and MP2/6-31G(d) level to model the molecules and predict their vibrational frequencies and rotational constants. A comparison of the predictions with the experimental spectra suggested that the linear isomer of the C5 molecule was responsible for the lines.

  10. Atmospheric chemistry research

    SciTech Connect

    Saylor, R.D. )

    1990-01-01

    Global environmental changes are occurring all around us, and the energy industry is a major player in the changes that are taking place. Wise energy policy can only be generated from a position of informed enlightenment and understanding about the environmental consequences of energy production and utilization. The atmospheric chemistry research being conducted at the University of Kentucky's Center for Applied Energy Research is geared toward providing the knowledge necessary to allow industrial and legislative officials to make responsible energy decisions in the 1990's and beyond. Three programs are described: the Kentucky Acid Deposition Program Precipitation chemistry network; modeling of regional and urban photochemistry and acid deposition; and modeling of global tropospheric chemistry.

  11. IR laser chemistry

    NASA Astrophysics Data System (ADS)

    Quack, Martin

    1995-01-01

    Recent progress in IR laser chemistry is reviewed with stress on the conceptual background and experimental advances from our research group. In particular we discuss various experimental schemes in laser chemistry as related to thermal reactions and ordinary photochemistry, and new results in time and frequency resolved kinetic IR spectroscopy at the limit defined by the uncertainty relation. The recent detection of hyperfine effects in IR laser chemistry is reviewed as well as nonlinear intensity dependence over many orders of magnitude including observations of nonlinear intensity fall-off and IR laser ionization of molecules. An outlook is presented on different time scales for intramolecular processes and the resulting future possibilities of IR laser chemical reaction control.

  12. Uranium triamidoamine chemistry.

    PubMed

    Gardner, Benedict M; Liddle, Stephen T

    2015-07-01

    Triamidoamine (Tren) complexes of the p- and d-block elements have been well-studied, and they display a diverse array of chemistry of academic, industrial and biological significance. Such in-depth investigations are not as widespread for Tren complexes of uranium, despite the general drive to better understand the chemical behaviour of uranium by virtue of its fundamental position within the nuclear sector. However, the chemistry of Tren-uranium complexes is characterised by the ability to stabilise otherwise reactive, multiply bonded main group donor atom ligands, construct uranium-metal bonds, promote small molecule activation, and support single molecule magnetism, all of which exploit the steric, electronic, thermodynamic and kinetic features of the Tren ligand system. This Feature Article presents a current account of the chemistry of Tren-uranium complexes.

  13. Air Composition and Chemistry

    NASA Astrophysics Data System (ADS)

    Brimblecombe, Peter

    1996-01-01

    This book is about the atmosphere and humanity's influence on it. For this new edition, Brimblecombe has rewritten and updated much of the book. In the early chapters, he discusses the geochemical, biological and maritime sources of the trace gases. Next, he examines the chemistry of atmospheric gases, suspended particles, and rainfall. After dealing with the natural atmosphere, he examines the sources of air pollution and its effects, with all scenarios updated from the last edition. Scenarios include decline in health, damage to plants and animals, indoor pollution, and acid rain. The final chapters, also revised, are concerned with the chemistry and evolution of the atmospheres of the planets of the solar system. Students with an interest in chemistry and the environmental sciences will find this book highly valuable.

  14. Digital biology and chemistry.

    PubMed

    Witters, Daan; Sun, Bing; Begolo, Stefano; Rodriguez-Manzano, Jesus; Robles, Whitney; Ismagilov, Rustem F

    2014-09-01

    This account examines developments in "digital" biology and chemistry within the context of microfluidics, from a personal perspective. Using microfluidics as a frame of reference, we identify two areas of research within digital biology and chemistry that are of special interest: (i) the study of systems that switch between discrete states in response to changes in chemical concentration of signals, and (ii) the study of single biological entities such as molecules or cells. In particular, microfluidics accelerates analysis of switching systems (i.e., those that exhibit a sharp change in output over a narrow range of input) by enabling monitoring of multiple reactions in parallel over a range of concentrations of signals. Conversely, such switching systems can be used to create new kinds of microfluidic detection systems that provide "analog-to-digital" signal conversion and logic. Microfluidic compartmentalization technologies for studying and isolating single entities can be used to reconstruct and understand cellular processes, study interactions between single biological entities, and examine the intrinsic heterogeneity of populations of molecules, cells, or organisms. Furthermore, compartmentalization of single cells or molecules in "digital" microfluidic experiments can induce switching in a range of reaction systems to enable sensitive detection of cells or biomolecules, such as with digital ELISA or digital PCR. This "digitizing" offers advantages in terms of robustness, assay design, and simplicity because quantitative information can be obtained with qualitative measurements. While digital formats have been shown to improve the robustness of existing chemistries, we anticipate that in the future they will enable new chemistries to be used for quantitative measurements, and that digital biology and chemistry will continue to provide further opportunities for measuring biomolecules, understanding natural systems more deeply, and advancing molecular and

  15. Chemistry of Transactinides

    NASA Astrophysics Data System (ADS)

    Kratz, J. V.

    In this chapter, the chemical properties of the man-made transactinide elements rutherfordium, Rf (element 104), dubnium, Db (element 105), seaborgium, Sg (element 106), bohrium, Bh (element 107), hassium, Hs (element 108), and copernicium, Cn (element 112) are reviewed, and prospects for chemical characterizations of even heavier elements are discussed. The experimental methods to perform rapid chemical separations on the time scale of seconds are presented and comments are given on the special situation with the transactinides where chemistry has to be studied with single atoms. It follows a description of theoretical predictions and selected experimental results on the chemistry of elements 104 through 108, and element 112.

  16. Chemistry in cometary comae.

    PubMed

    Irvine, W M; Dickens, J E; Lovell, A J; Schloerb, F P; Senay, M; Bergin, E A; Jewitt, D; Matthews, H E

    1998-01-01

    Significant gas-phase chemistry occurs in the comae of bright comets, as is demonstrated here for the case of Comet Hale-Bopp. The abundance ratio of the two isomers, hydrogen cyanide and hydrogen isocyanide, is shown to vary with heliocentric distance in a way that is consistent with production of HNC by ion-molecule chemistry initiated by the photoionization of water. Likewise, the first maps of emission from HCO+ show an abundance and an extended distribution that are consistent with the same chemical model.

  17. Chemistry WebBook

    National Institute of Standards and Technology Data Gateway

    SRD 69 NIST Chemistry WebBook (Web, free access)   The NIST Chemistry WebBook contains: Thermochemical data for over 7000 organic and small inorganic compounds; thermochemistry data for over 8000 reactions; IR spectra for over 16,000 compounds; mass spectra for over 33,000 compounds; UV/Vis spectra for over 1600 compounds; electronic and vibrational spectra for over 5000 compounds; constants of diatomic molecules(spectroscopic data) for over 600 compounds; ion energetics data for over 16,000 compounds; thermophysical property data for 74 fluids.

  18. Chemistry in cometary comae

    NASA Technical Reports Server (NTRS)

    Irvine, W. M.; Dickens, J. E.; Lovell, A. J.; Schloerb, F. P.; Senay, M.; Bergin, E. A.; Jewitt, D.; Matthews, H. E.

    1998-01-01

    Significant gas-phase chemistry occurs in the comae of bright comets, as is demonstrated here for the case of Comet Hale-Bopp. The abundance ratio of the two isomers, hydrogen cyanide and hydrogen isocyanide, is shown to vary with heliocentric distance in a way that is consistent with production of HNC by ion-molecule chemistry initiated by the photoionization of water. Likewise, the first maps of emission from HCO+ show an abundance and an extended distribution that are consistent with the same chemical model.

  19. Chemistry in Second Life

    PubMed Central

    Lang, Andrew SID; Bradley, Jean-Claude

    2009-01-01

    This review will focus on the current level on chemistry research, education, and visualization possible within the multi-user virtual environment of Second Life. We discuss how Second Life has been used as a platform for the interactive and collaborative visualization of data from molecules and proteins to spectra and experimental data. We then review how these visualizations can be scripted for immersive educational activities and real-life collaborative research. We also discuss the benefits of the social networking affordances of Second Life for both chemists and chemistry students. PMID:19852781

  20. Revitalizing chemistry laboratory instruction

    NASA Astrophysics Data System (ADS)

    McBride, Phil Blake

    This dissertation involves research in three major domains of chemical education as partial fulfillment of the requirements for the Ph.D. program in chemistry at Miami University with a major emphasis on chemical education, and concurrent study in organic chemistry. Unit I, Development and Assessment of a Column Chromatography Laboratory Activity, addresses the domain of Instructional Materials Development and Testing. This unit outlines the process of developing a publishable laboratory activity, testing and revising that activity, and subsequently sharing that activity with the chemical education community. A laboratory activity focusing on the separation of methylene blue and sodium fluorescein was developed to demonstrate the effects of both the stationary and mobile phase in conducting a separation. Unit II, Bringing Industry to the Laboratory, addresses the domain of Curriculum Development and Testing. This unit outlines the development of the Chemistry of Copper Mining module, which is intended for use in high school or undergraduate college chemistry. The module uses the learning cycle approach to present the chemistry of the industrial processes of mining copper to the students. The module includes thirteen investigations (three of which are web-based and ten which are laboratory experiments) and an accompanying interactive CD-ROM, which provides an explanation of the chemistry used in copper mining with a virtual tour of an operational copper mine. Unit III, An Alternative Method of Teaching Chemistry. Integrating Lecture and the Laboratory, is a project that addresses the domain of Research in Student Learning. Fundamental Chemistry was taught at Eastern Arizona College as an integrated lecture/laboratory course that met in two-hour blocks on Monday, Wednesday, and Friday. The students taking this integrated course were compared with students taking the traditional 1-hour lectures held on Monday, Wednesday, and Friday, with accompanying 3-hour lab on

  1. Top Down Chemistry Versus Bottom up Chemistry

    NASA Astrophysics Data System (ADS)

    Oka, Takeshi; Witt, Adolf N.

    2016-06-01

    The idea of interstellar top down chemistry (TDC), in which molecules are produced from decomposition of larger molecules and dust in contrast to ordinary bottom up chemistry (BUC) in which molecules are produced synthetically from smaller molecules and atoms in the ISM, has been proposed in the chemistry of PAH and carbon chain molecules both for diffusea,c and dense cloudsb,d. A simple and natural idea, it must have occurred to many people and has been in the air for sometime. The validity of this hypothesis is apparent for diffuse clouds in view of the observed low abundance of small molecules and its rapid decrease with molecular size on the one hand and the high column densities of large carbon molecules demonstrated by the many intense diffuse interstellar bands (DIBs) on the other. Recent identification of C60^+ as the carrier of 5 near infrared DIBs with a high column density of 2×1013 cm-2 by Maier and others confirms the TDC. This means that the large molecules and dust produced in the high density high temperature environment of circumstellar envelopes are sufficiently stable to survive decompositions due to stellar UV radiaiton, cosmic rays, C-shocks etc. for a long time (≥ 10^7 year) of their migration to diffuse clouds and seems to disagree with the consensus in the field of interstellar grains. The stability of molecules and aggregates in the diffuse interstellar medium will be discussed. Duley, W. W. 2006, Faraday Discuss. 133, 415 Zhen,J., Castellanos, P., Paardekooper, D. M., Linnartz, H., Tielens, A. G. G. M. 2014, ApJL, 797, L30 Huang, J., Oka, T. 2015, Mol. Phys. 113, 2159 Guzmán, V. V., Pety, J., Goicoechea, J. R., Gerin, M., Roueff, E., Gratier, P., Öberg, K. I. 2015, ApJL, 800, L33 L. Ziurys has sent us many papers beginning Ziurys, L. M. 2006, PNAS 103, 12274 indicating she had long been a proponent of the idea. Campbell, E. K., Holz, M., Maier, J. P., Gerlich, D., Walker, G. A. H., Bohlender, D, 2016, ApJ, in press Draine, B. T. 2003

  2. Structure and chemistry of model catalysts in ultrahigh vacuum

    NASA Astrophysics Data System (ADS)

    Walker, Joshua D.

    molecular geometry on electron transport using a range of surface-sensitive techniques. Sulfur-containing molecules, in particular those with sulfur-sulfur linkages, are used as lubricant additives for ferrous surfaces [1-14] so that dialkyl disulfides have been used as simple model compounds to explore the surface and tribological chemistry on iron [15,16] where they react at the high temperatures attained at the interface during rubbing to deposit a ferrous sulfide film. However, the tribological chemistry can depend critically on the nature of the substrate so that a good lubricant additive for one type of surface may not be applicable to another. In particular, the lubrication of sliding copper-copper interfaces in electrical motors [17-20] provides a particular challenge. To study this system surface sensitive techniques Low energy electron diffraction (LEED) and TPD surface analysis was employed. LEED experiments suggest that tribological experiments can be conducted on copper foils rather than copper single crystals and produce comparable results. The ability to produce ideal model catalysts is very important in the Surface science field. To enhance catalytic performance of these catalysts, various strategies can be used in the preparation process. One approach in this quest is to produce an alloy surface that increases the activity of the surface. The process of developing and understanding the chemistry of AuPd alloys was probed in detail using TPD, LEED and Density Functional Theory (DFT).

  3. Organic Chemistry Self Instructional Package 1: Review of General Chemistry.

    ERIC Educational Resources Information Center

    Zdravkovich, V.

    This booklet is one of a series of 17 developed at Prince George's Community College, Largo, Maryland. It provides an individualized, self-paced undergraduate organic chemistry instruction module designed to augment any course in organic chemistry but particularly those taught using the text "Organic Chemistry" by Morrison and Boyd. The entire…

  4. Emphasizing Mineral Chemistry in an Analytical Chemistry Unit.

    ERIC Educational Resources Information Center

    Dunn, Jeffrey G.; And Others

    1995-01-01

    Describes an analytical chemistry unit in the second year of the chemistry degree course at Curtin University that was designed to reflect the numerous employment opportunities for chemistry graduates in the mineral processing industries and private analytical laboratories. Presents the lecture syllabus, the laboratory course description, and…

  5. Chemistry: Experiments, Demonstrations and Other Activities Suggested for Chemistry.

    ERIC Educational Resources Information Center

    New York State Education Dept., Albany. Bureau of Secondary Curriculum Development.

    This publication is a handbook used in conjunction with the course of study in chemistry developed through the New York State Education Department and The University of the State of New York. It contains experiments, demonstrations, and other activities for a chemistry course. Areas covered include the science of chemistry, the atomic structure of…

  6. Is Chemistry Attractive for Pupils? Czech Pupils' Perception of Chemistry

    ERIC Educational Resources Information Center

    Kubiatko, Milan

    2015-01-01

    Chemistry is an important subject due to understanding the composition and structure of the things around us. The main aim of the study was to find out the perception of chemistry by lower secondary school pupils. The partial aims were to find out the influence of gender, year of study and favorite subject on the perception of chemistry. The…

  7. Connected Chemistry--Incorporating Interactive Simulations into the Chemistry Classroom.

    ERIC Educational Resources Information Center

    Stieff, Mike; Wilensky, Uri

    2003-01-01

    Describes a novel modeling and simulation package and assesses its impact on students' understanding of chemistry. Connected Chemistry was implemented inside the NetLogo modeling environment. Using Connected Chemistry, students employed problem -solving techniques characterized by stronger attempts at conceptual understanding and logical…

  8. Chemistry and Popperism.

    ERIC Educational Resources Information Center

    Akeroyd, F. Michael

    1984-01-01

    Discusses the relationship of Karl Popper's theories to chemistry, examining scientific statements and verisimilitude (which indicates that newer theories should have a higher degree of truth content compared with older theories). Also provides examples illustrating the use of Agassi's criteria for assessing currently fashionable theories. (JN)

  9. The Lens of Chemistry

    ERIC Educational Resources Information Center

    Thalos, Mariam

    2013-01-01

    Chemistry possesses a distinctive theoretical lens--a distinctive set of theoretical concerns regarding the dynamics and transformations of a perplexing variety of organic and nonorganic substances--to which it must be faithful. Even if it is true that chemical facts bear a special (reductive) relationship to physical facts, nonetheless it will…

  10. Chemistry and Heritage

    NASA Astrophysics Data System (ADS)

    Vittoria Barbarulo, Maria

    2014-05-01

    Chemistry is the central science, as it touches every aspect of the society we live in and it is intertwined with many aspects of our culture; in particular, the strong link between Chemistry and Archaeology and Art History is being explored, offering a penetrating insight into an area of growing interest from an educational point of view. A series of vital and vibrant examples (i.e., ancient bronzes composition, colour changes due to natural pigment decomposition, marble degradation) has been proposed, on one hand, to improve student understanding of the relationship between cultural and scientific issues arising from the examination, the conservation, and the maintenance of cultural Heritage, on the other, to illustrate the role of the underlying Chemistry. In some case studies, a survey of the most relevant atmospheric factors, which are involved in the deterioration mechanisms, has also been presented to the students. First-hand laboratory experiences have been providing an invaluable means of discovering the full and varied world of Chemistry. Furthermore, the promotion of an interdisciplinary investigation of a famous painting or fresco, involving the study of its nature and significance, the definition of its historical context, any related literature, the chemical knowledge of the materials used, may be an excellent occasion to experiment the Content and Language Integrated Learning (CLIL). The aim of this approach is to convey the important message that everyone has the responsibility to care for and preserve Heritage for the benefit of present and future generations.

  11. Myrrh--Commiphora chemistry.

    PubMed

    Hanus, Lumír O; Rezanka, Tomás; Dembitsky, Valery M; Moussaieff, Arieh

    2005-06-01

    Myrrh and opopanax has been used throughout history in incense and as a perfume. Since Bible times it has been used for the treatment of wounds. The first attempts to identify content compounds were almost 100 years ago. In this review we discuss the present state of knowledge in the chemistry of substances of Commiphora spp. PMID:16170385

  12. The Chemistry of Health

    ERIC Educational Resources Information Center

    Davis, Alison

    2009-01-01

    Do people realize that chemistry plays a key role in helping solve some of the most serious problems facing the world today? Chemists want to find the building blocks of the chemical universe--the molecules that form materials, living cells and whole organisms. Many chemists are medical explorers looking for new ways to maintain and improve…

  13. Chemistry in the Troposphere.

    ERIC Educational Resources Information Center

    Chameides, William L.; Davis, Douglas D.

    1982-01-01

    Topics addressed in this review of chemistry in the troposphere (layer of atmosphere extending from earth's surface to altitude of 10-16km) include: solar radiation/winds; earth/atmosphere interface; kinetic studies of atmospheric reactions; tropospheric free-radical photochemistry; instruments for nitric oxide detection; sampling…

  14. Array processors in chemistry

    SciTech Connect

    Ostlund, N.S.

    1980-01-01

    The field of attached scientific processors (''array processors'') is surveyed, and an attempt is made to indicate their present and possible future use in computational chemistry. The current commercial products from Floating Point Systems, Inc., Datawest Corporation, and CSP, Inc. are discussed.

  15. The Chemistry of Health.

    ERIC Educational Resources Information Center

    National Inst. of General Medical Sciences (NIH), Bethesda, MD.

    This booklet, geared toward an advanced high school or early college-level audience, describes how basic chemistry and biochemistry research can spur a better understanding of human health. It reveals how networks of chemical reactions keep our bodies running smoothly. Some of the tools and technologies used to explore these reactions are…

  16. Chemistry Cook-Off

    ERIC Educational Resources Information Center

    McCormick, Cynthia

    2012-01-01

    For this activity, high school chemistry students compete in a cooking contest. They must determine the chemical and physical changes that occur in the food they prepare, present their recipe as a step-by-step procedure similar to a lab procedure, identify chemicals in the food, and present all measurements in both metric and English units. The…

  17. Epoxying Isoprene Chemistry

    EPA Science Inventory

    It seems that every few months we read about another missing aspect of atmospheric chemistry: missing products, missing reactivity, missing sources, missing understanding. Thus, it is with some relief that we read in this issue the paper of Paulot et al. The paper provides more...

  18. Chemistry of Meridiani Outcrops

    NASA Technical Reports Server (NTRS)

    Clark, B. C.; Squyres, S. W.; Ming, D. W.; Morris, R. V.; Yen, A.; Gellert, R.; Knoll, A.H.; Arvidson, R. E.

    2006-01-01

    The chemistry and mineralogy of the sulfate-rich sandstone outcrops at Meridiani Planum, Mars, have been inferred from data obtained by the Opportunity rover of the MER mission and reported in recent publications [1-6]. Here, we provide an update on more recent samples and results derived from this extensive data set.

  19. General Chemistry, 1970 Edition.

    ERIC Educational Resources Information Center

    Dunham, Orson W.; Franke, Douglas C.

    This publication is a syllabus for a senior high school chemistry course designed for the average ability, nonscience major. The content of the syllabus is divided into three basic core areas: Area I: Similarities and Dissimilarities of Matter (9 weeks); Area II: Preparation and Separation of Substances (10 weeks); Area III: Structure and…

  20. News: Green Chemistry & Technology

    EPA Science Inventory

    A series of 21 articles focused on different features of green chemistry in a recent issue of Chemical Reviews. Topics extended over a wide range to include the design of sustainable synthetic processes to biocatalysis. A selection of perspectives follows as part of this colu

  1. Microscale Gas Chemistry

    ERIC Educational Resources Information Center

    Mattson, Bruce; Anderson, Michael P.

    2011-01-01

    The development of syringes having free movement while remaining gas-tight enabled methods in chemistry to be changed. Successfully containing and measuring volumes of gas without the need to trap them using liquids made it possible to work with smaller quantities. The invention of the LuerLok syringe cap also allowed the gas to be stored for a…

  2. Chemistry between the stars

    NASA Technical Reports Server (NTRS)

    Gammon, R. H.

    1976-01-01

    A unit is presented for the secondary school teacher of physics, chemistry, astronomy, or earth sciences. Included are a list of reference materials, teaching aids, and projects. Discussion questions and a glossary are also provided. Concepts developed are: the nature of interstellar space, spectroscopy, molecular signals from space and interstellar molecules and other areas of astronomy.

  3. Chemistry Between The Stars.

    ERIC Educational Resources Information Center

    Gammon, Richard H.

    This booklet is part of an American Astronomical Society curriculum project designed to provide teaching materials to teachers of secondary school chemistry, physics, and earth science. The following topics are covered: the physical conditions in interstellar space in comparison with those of the earth, particularly in regard to gas density,…

  4. The Language of Chemistry.

    ERIC Educational Resources Information Center

    Bretz, Stacey Lowery; Meinwald, Jerrold

    2002-01-01

    Describes a new curriculum called The Language of Chemistry designed to illustrate how problems of biological and/or medical importance can be understood on a molecular basis and to show that the logic, knowledge, and language needed are easily accessible. Among the case studies in the curriculum are the giant peacock moth, bacterial chemotaxis,…

  5. The Pimlico Chemistry Trail.

    ERIC Educational Resources Information Center

    Borrows, Peter

    1984-01-01

    Describes a chemistry "trail" (similar to a nature trail) which focuses on chemical phenomena in the environment. The trail includes 20 stops in and around a local school. Types of phenomena examined include building materials, air pollution, corrosion of metals, swimming pools, and others. Additional activities are also suggested. (DH)

  6. Get Cooking with Chemistry!

    ERIC Educational Resources Information Center

    American Chemical Society, Washington, DC.

    This book presents science activities investigating the chemical changes and reactions with powders that are used in baking. Activities include: (1) Mystery Powders; (2) Find the Fizz: Discover the Secret of Baking Powder; and (3) A Feast for Yeast and Cheese: Behold the Power of Chemistry. (YDS)

  7. Greener and Sustainable Chemistry

    EPA Science Inventory

    The special issue on Greener and Sustainable Chemistry highlights various strategies that can be adopted to address the pollution preventive measures promoting the use of energy efficient reactions that utilize benign and bio-renewable raw materials in a relatively safer reaction...

  8. Nobel Prize in Chemistry

    NASA Astrophysics Data System (ADS)

    2000-01-01

    The Royal Swedish Academy has awarded the 1999 Nobel Prize in Chemistry to Ahmed H. Zewail (California Institute of Technology, Pasadena, CA) "for his studies of the transition states of chemical reactions using femtosecond spectroscopy". Zewail's work has taken the study of the rates and mechanisms of chemical reactions to the ultimate degree of detail - the time scale of bond making and bond breaking.

  9. Chemistry Curricula. Course Suggestions.

    ERIC Educational Resources Information Center

    American Chemical Society, Washington, DC.

    Listings of suggested topics aimed at helping university and college faculties plan courses in the main areas of the chemistry curricula are provided. The suggestions were originally offered as appendices to the American Chemical Society's (ACS) Committee on Professional Training's 1983 guidelines for ACS-approved schools. The course data included…

  10. Myrrh--Commiphora chemistry.

    PubMed

    Hanus, Lumír O; Rezanka, Tomás; Dembitsky, Valery M; Moussaieff, Arieh

    2005-06-01

    Myrrh and opopanax has been used throughout history in incense and as a perfume. Since Bible times it has been used for the treatment of wounds. The first attempts to identify content compounds were almost 100 years ago. In this review we discuss the present state of knowledge in the chemistry of substances of Commiphora spp.

  11. Bringing chemistry to life

    PubMed Central

    Boyce, Michael; Bertozzi, Carolyn R

    2011-01-01

    Bioorthogonal chemistry allows a wide variety of biomolecules to be specifically labeled and probed in living cells and whole organisms. Here we discuss the history of bioorthogonal reactions and some of the most interesting and important advances in the field. PMID:21799498

  12. Getting Reactions to Chemistry.

    ERIC Educational Resources Information Center

    Smith, Walter S.

    1983-01-01

    "COMETS on Careers" describes science-related careers, introduces activities illustrating a science concept being studied, and encourages use of professional persons as activity leaders. Several COMETS chemistry activities are described. These activities, which can be performed in school or at home, focus on colloids, acid/base indicators, and…

  13. Water Chemistry Laboratory Manual.

    ERIC Educational Resources Information Center

    Jenkins, David; And Others

    This manual of laboratory experiments in water chemistry serves a dual function of illustrating fundamental chemical principles of dilute aqueous systems and of providing the student with some familiarity with the chemical measurements commonly used in water and wastewater analysis. Experiments are grouped in categories on the basis of similar…

  14. Online Organic Chemistry

    ERIC Educational Resources Information Center

    Janowicz, Philip A.

    2010-01-01

    This is a comprehensive study of the many facets of an entirely online organic chemistry course. Online homework with structure-drawing capabilities was found to be more effective than written homework. Online lecture was found to be just as effective as in-person lecture, and students prefer an online lecture format with shorter Webcasts. Online…

  15. Chemistry in a Nutshell.

    ERIC Educational Resources Information Center

    Rupnow, John; And Others

    1995-01-01

    Presents an activity that involves making peanut butter in the laboratory as a way to teach students the chemistry concepts of emulsification, solubility, and formulation. Enables students to realize that they can actually create or modify the physical and sensory characteristics of peanut butter and taste the differences in their work. (JRH)

  16. Green chemistry metrics

    EPA Science Inventory

    Synthetic chemists have always had an objective to achieve reliable and high-yielding routes to the syntheses of targeted molecules. The importance of minimal waste generation has emphasized the use of green chemistry principles and sustainable development. These directions lead ...

  17. Analytical Chemistry Laboratory

    NASA Technical Reports Server (NTRS)

    Anderson, Mark

    2013-01-01

    The Analytical Chemistry and Material Development Group maintains a capability in chemical analysis, materials R&D failure analysis and contamination control. The uniquely qualified staff and facility support the needs of flight projects, science instrument development and various technical tasks, as well as Cal Tech.

  18. The Lighter Side of Chemistry.

    ERIC Educational Resources Information Center

    Lamb, William G.

    1984-01-01

    Discusses the rationale for using photochemistry to merge descriptive chemistry and molecular orbital theory in first-year chemistry courses. Includes procedures and safety information for various activities, demonstrations, and experiments involving photochemical reactions. (DH)

  19. The Birthday of Organic Chemistry.

    ERIC Educational Resources Information Center

    Benfey, Otto Theodor; Kaufman, George B.

    1979-01-01

    Describes how the synthesis of urea, 150 years ago, was a major factor in breaking the artificial barrier that existed between organic and inorganic chemistry, and this contributed to the rapid growth of organic chemistry. (GA)

  20. Special Report: Chemistry of Comets.

    ERIC Educational Resources Information Center

    A'Hearn, Michael F.

    1984-01-01

    Discusses the chemistry of comets. How comets provide clues to the birth of the solar system, photolytic reactions on comets involving water, chemical modeling, nuclear chemistry, and research findings are among the areas considered. (JN)

  1. Chemistry 200, 300 Interim Guide.

    ERIC Educational Resources Information Center

    Manitoba Dept. of Education, Winnipeg.

    This guide, developed for the chemistry 200, 300 program in Manitoba, is designed to articulate with previous science courses, provide concepts, processes, and skills which will enable students to continue in chemistry-related areas, and relate chemistry to practical applications in everyday life. It includes a program overview (with program goals…

  2. Six Pillars of Organic Chemistry

    ERIC Educational Resources Information Center

    Mullins, Joseph J.

    2008-01-01

    This article describes an approach to teaching organic chemistry, which is to have students build their knowledge of organic chemistry upon a strong foundation of the fundamental concepts of the subject. Specifically, the article focuses upon a core set of concepts that I call "the six pillars of organic chemistry": electronegativity, polar…

  3. Chemistry Sets Face Uncertain Future.

    ERIC Educational Resources Information Center

    Stinson, Stephen C.

    1979-01-01

    Chemistry sets, often a child's first contact with chemistry, are becoming less attractive to manufacturers as the market for these items decreases. There is a tendency for recently manufactured chemistry sets to be less adequate than those selling in the same price range in past years. Manuals vary in quality among manufacturers. (RE)

  4. Towards "Bildung"-Oriented Chemistry Education

    ERIC Educational Resources Information Center

    Sjöström, Jesper

    2013-01-01

    This paper concerns "Bildung"-oriented chemistry education, based on a reflective and critical discourse of chemistry. It is contrasted with the dominant type of chemistry education, based on the mainstream discourse of chemistry. "Bildung"-oriented chemistry education includes not only content knowledge in chemistry, but also…

  5. Chemistry of superheavy elements.

    PubMed

    Schädel, Matthias

    2006-01-01

    The number of chemical elements has increased considerably in the last few decades. Most excitingly, these heaviest, man-made elements at the far-end of the Periodic Table are located in the area of the long-awaited superheavy elements. While physical techniques currently play a leading role in these discoveries, the chemistry of superheavy elements is now beginning to be developed. Advanced and very sensitive techniques allow the chemical properties of these elusive elements to be probed. Often, less than ten short-lived atoms, chemically separated one-atom-at-a-time, provide crucial information on basic chemical properties. These results place the architecture of the far-end of the Periodic Table on the test bench and probe the increasingly strong relativistic effects that influence the chemical properties there. This review is focused mainly on the experimental work on superheavy element chemistry. It contains a short contribution on relativistic theory, and some important historical and nuclear aspects.

  6. Organic Chemistry in Space

    NASA Technical Reports Server (NTRS)

    Charnley, Steven

    2009-01-01

    Astronomical observations, theoretical modeling, laboratory simulation and analysis of extraterrestrial material have enhanced our knowledge of the inventory of organic matter in the interstellar medium (ISM) and on small bodies such as comets and asteroids (Ehrenfreund & Charnley 2000). Comets, asteroids and their fragments, meteorites and interplanetary dust particles (IDPs), contributed significant amounts of extraterrestrial organic matter to the young Earth. This material degraded and reacted in a terrestrial prebiotic chemistry to form organic structures that may have served as building blocks for life on the early Earth. In this talk I will summarize our current understanding of the organic composition and chemistry of interstellar clouds. Molecules of astrobiological relevance include the building blocks of our genetic material: nucleic acids, composed of subunits such as N-heterocycles (purines and pyrimidines), sugars and amino acids. Signatures indicative of inheritance of pristine and modified interstellar material in comets and meteorites will also be discussed.

  7. Turbine Chemistry Modeling

    NASA Technical Reports Server (NTRS)

    Liu, Nan-Suey; Wey, Thomas

    2001-01-01

    Many of the engine exhaust species resulting in significant environmental impact exist in trace amounts. Recent research, e.g., conducted at MIT-AM, has pointed to the intra-engine environment as a possible site for important trace chemistry activity. In addition, the key processes affecting the trace species activity occurring downstream in the air passages of the turbine and exhaust nozzle are not well understood. Most recently, an effort has been initiated at NASA Glenn Research Center under the UEET Program to evaluate and further develop CFD-based technology for modeling and simulation of intra-engine trace chemical changes relevant to atmospheric effects of pollutant emissions from aircraft engines. This presentation will describe the current effort conducted at Glenn; some preliminary results relevant to the trace species chemistry in a turbine passage will also be presented to indicate the progress to date.

  8. Quo vadis, analytical chemistry?

    PubMed

    Valcárcel, Miguel

    2016-01-01

    This paper presents an open, personal, fresh approach to the future of Analytical Chemistry in the context of the deep changes Science and Technology are anticipated to experience. Its main aim is to challenge young analytical chemists because the future of our scientific discipline is in their hands. A description of not completely accurate overall conceptions of our discipline, both past and present, to be avoided is followed by a flexible, integral definition of Analytical Chemistry and its cornerstones (viz., aims and objectives, quality trade-offs, the third basic analytical reference, the information hierarchy, social responsibility, independent research, transfer of knowledge and technology, interfaces to other scientific-technical disciplines, and well-oriented education). Obsolete paradigms, and more accurate general and specific that can be expected to provide the framework for our discipline in the coming years are described. Finally, the three possible responses of analytical chemists to the proposed changes in our discipline are discussed. PMID:26631024

  9. Heterogeneous atmospheric chemistry

    NASA Technical Reports Server (NTRS)

    Schryer, D. R.

    1982-01-01

    The present conference on heterogeneous atmospheric chemistry considers such topics concerning clusters, particles and microparticles as common problems in nucleation and growth, chemical kinetics, and catalysis, chemical reactions with aerosols, electron beam studies of natural and anthropogenic microparticles, and structural studies employing molecular beam techniques, as well as such gas-solid interaction topics as photoassisted reactions, catalyzed photolysis, and heterogeneous catalysis. Also discussed are sulfur dioxide absorption, oxidation, and oxidation inhibition in falling drops, sulfur dioxide/water equilibria, the evidence for heterogeneous catalysis in the atmosphere, the importance of heterogeneous processes to tropospheric chemistry, soot-catalyzed atmospheric reactions, and the concentrations and mechanisms of formation of sulfate in the atmospheric boundary layer.

  10. Nuclear analytical chemistry

    SciTech Connect

    Brune, D.; Forkman, B.; Persson, B.

    1984-01-01

    This book covers the general theories and techniques of nuclear chemical analysis, directed at applications in analytical chemistry, nuclear medicine, radiophysics, agriculture, environmental sciences, geological exploration, industrial process control, etc. The main principles of nuclear physics and nuclear detection on which the analysis is based are briefly outlined. An attempt is made to emphasise the fundamentals of activation analysis, detection and activation methods, as well as their applications. The book provides guidance in analytical chemistry, agriculture, environmental and biomedical sciences, etc. The contents include: the nuclear periodic system; nuclear decay; nuclear reactions; nuclear radiation sources; interaction of radiation with matter; principles of radiation detectors; nuclear electronics; statistical methods and spectral analysis; methods of radiation detection; neutron activation analysis; charged particle activation analysis; photon activation analysis; sample preparation and chemical separation; nuclear chemical analysis in biological and medical research; the use of nuclear chemical analysis in the field of criminology; nuclear chemical analysis in environmental sciences, geology and mineral exploration; and radiation protection.

  11. Quo vadis, analytical chemistry?

    PubMed

    Valcárcel, Miguel

    2016-01-01

    This paper presents an open, personal, fresh approach to the future of Analytical Chemistry in the context of the deep changes Science and Technology are anticipated to experience. Its main aim is to challenge young analytical chemists because the future of our scientific discipline is in their hands. A description of not completely accurate overall conceptions of our discipline, both past and present, to be avoided is followed by a flexible, integral definition of Analytical Chemistry and its cornerstones (viz., aims and objectives, quality trade-offs, the third basic analytical reference, the information hierarchy, social responsibility, independent research, transfer of knowledge and technology, interfaces to other scientific-technical disciplines, and well-oriented education). Obsolete paradigms, and more accurate general and specific that can be expected to provide the framework for our discipline in the coming years are described. Finally, the three possible responses of analytical chemists to the proposed changes in our discipline are discussed.

  12. Carbohydrates in Supramolecular Chemistry.

    PubMed

    Delbianco, Martina; Bharate, Priya; Varela-Aramburu, Silvia; Seeberger, Peter H

    2016-02-24

    Carbohydrates are involved in a variety of biological processes. The ability of sugars to form a large number of hydrogen bonds has made them important components for supramolecular chemistry. We discuss recent advances in the use of carbohydrates in supramolecular chemistry and reveal that carbohydrates are useful building blocks for the stabilization of complex architectures. Systems are presented according to the scaffold that supports the glyco-conjugate: organic macrocycles, dendrimers, nanomaterials, and polymers are considered. Glyco-conjugates can form host-guest complexes, and can self-assemble by using carbohydrate-carbohydrate interactions and other weak interactions such as π-π interactions. Finally, complex supramolecular architectures based on carbohydrate-protein interactions are discussed.

  13. Atmospheric Chemistry Data Products

    NASA Technical Reports Server (NTRS)

    2003-01-01

    This presentation poster covers data products from the Distributed Active Archive Center (DAAC) of the Goddard Earth Sciences (GES) Data and Information Services Center (DISC). Total Ozone Mapping Spectrometer products (TOMS) introduced in the presentation include TOMS Version 8 as well as Aura, which provides 25 years of TOMS and Upper Atmosphere Research Satellite (UARS) data. The presentation lists a number of atmospheric chemistry and dynamics data sets at DAAC.

  14. Green chemistry: development trajectory

    NASA Astrophysics Data System (ADS)

    Moiseev, I. I.

    2013-07-01

    Examples of applications of green chemistry methods in heavy organic synthesis are analyzed. Compounds, which can be produced by the processing of the biomass, and the criteria for the selection of the most promising products are summarized. The current status of the ethanol production and processing is considered. The possibilities of the use of high fatty acid triglycerides, glycerol, succinic acid, and isoprene are briefly discussed. The bibliography includes 67 references.

  15. Wet chemistry instrument prototype

    NASA Technical Reports Server (NTRS)

    1974-01-01

    A wet chemistry instrument prototype for detecting amino acids in planetary soil samples was developed. The importance of amino acids and their condensation products to the development of life forms is explained. The characteristics of the instrument and the tests which were conducted to determine the materials compatibility are described. Diagrams are provided to show the construction of the instrument. Data obtained from the performance tests are reported.

  16. Analytical Chemistry in Russia.

    PubMed

    Zolotov, Yuri

    2016-09-01

    Research in Russian analytical chemistry (AC) is carried out on a significant scale, and the analytical service solves practical tasks of geological survey, environmental protection, medicine, industry, agriculture, etc. The education system trains highly skilled professionals in AC. The development and especially manufacturing of analytical instruments should be improved; in spite of this, there are several good domestic instruments and other satisfy some requirements. Russian AC has rather good historical roots.

  17. Chemistry and cosmology.

    PubMed

    Black, John H

    2006-01-01

    The simplest elements, hydrogen and helium, offer a remarkably rich chemistry, which has controlled crucial features of the early evolution of the universe. Theoretical models of the origin of structure (stars, galaxies, clusters of galaxies, etc.) now incorporate this chemistry in some detail. In addition to the origin of structure, cosmologists are concerned with observational tests of competing world models. Primordial chemistry may give rise to some of the earliest departures from thermodynamic equilibrium in the universe. These effects may be observable as broad-band spectroscopic distortions of the cosmic background radiation, which otherwise exhibits a nearly perfect blackbody spectrum. The chemical history of the expanding universe is followed through a detailed calculation of the evolution of the abundances of H, H+, H-, H2, H2+, H3+, and other minor species. It is shown that continuous absorption by the small concentration of H- can produce a distortion in the cosmic background spectrum with a maximum at a frequency near nu/c = 9 cm-1 (wavelength 1.1 mm). The predicted effect lies only a factor of 5 below current limits. Its detection would provide an important test of our understanding of the recombination epoch of the universe. PMID:17191439

  18. Advanced Chemistry Basins Model

    SciTech Connect

    William Goddard; Mario Blanco; Lawrence Cathles; Paul Manhardt; Peter Meulbroek; Yongchun Tang

    2002-11-10

    The DOE-funded Advanced Chemistry Basin model project is intended to develop a public domain, user-friendly basin modeling software under PC or low end workstation environment that predicts hydrocarbon generation, expulsion, migration and chemistry. The main features of the software are that it will: (1) afford users the most flexible way to choose or enter kinetic parameters for different maturity indicators; (2) afford users the most flexible way to choose or enter compositional kinetic parameters to predict hydrocarbon composition (e.g., gas/oil ratio (GOR), wax content, API gravity, etc.) at different kerogen maturities; (3) calculate the chemistry, fluxes and physical properties of all hydrocarbon phases (gas, liquid and solid) along the primary and secondary migration pathways of the basin and predict the location and intensity of phase fractionation, mixing, gas washing, etc.; and (4) predict the location and intensity of de-asphaltene processes. The project has be operative for 36 months, and is on schedule for a successful completion at the end of FY 2003.

  19. Extensible Computational Chemistry Environment

    2012-08-09

    ECCE provides a sophisticated graphical user interface, scientific visualization tools, and the underlying data management framework enabling scientists to efficiently set up calculations and store, retrieve, and analyze the rapidly growing volumes of data produced by computational chemistry studies. ECCE was conceived as part of the Environmental Molecular Sciences Laboratory construction to solve the problem of researchers being able to effectively utilize complex computational chemistry codes and massively parallel high performance compute resources. Bringing themore » power of these codes and resources to the desktops of researcher and thus enabling world class research without users needing a detailed understanding of the inner workings of either the theoretical codes or the supercomputers needed to run them was a grand challenge problem in the original version of the EMSL. ECCE allows collaboration among researchers using a web-based data repository where the inputs and results for all calculations done within ECCE are organized. ECCE is a first of kind end-to-end problem solving environment for all phases of computational chemistry research: setting up calculations with sophisticated GUI and direct manipulation visualization tools, submitting and monitoring calculations on remote high performance supercomputers without having to be familiar with the details of using these compute resources, and performing results visualization and analysis including creating publication quality images. ECCE is a suite of tightly integrated applications that are employed as the user moves through the modeling process.« less

  20. General chemistry students' understanding of the chemistry underlying climate science

    NASA Astrophysics Data System (ADS)

    Versprille, Ashley N.

    The purpose of this study is to investigate first-semester general chemistry students' understanding of the chemistry underlying climate change. The first part of this study involves the collection of qualitative data from twenty-four first-semester general chemistry students from a large Midwestern research institution. The semi-structured interview protocol was developed based on alternative conceptions identified in the research literature and the essential principles of climate change outlined in the U.S. Climate Change Science Program (CCSP) document which pertain to chemistry (CCSP, 2003). The analysis and findings from the interviews indicate conceptual difficulties for students, both with basic climate literacy and underlying chemistry concepts. Students seem to confuse the greenhouse effect, global warming, and the ozone layer, and in terms of chemistry concepts, they lack a particulate level understanding of greenhouse gases and their interaction with electromagnetic radiation, causing them to not fully conceptualize the greenhouse effect and climate change. Based on the findings from these interviews, a Chemistry of Climate Science Diagnostic Instrument (CCSI) was developed for use in courses that teach chemistry with a rich context such as climate science. The CCSI is designed for professors who want to teach general chemistry, while also addressing core climate literacy principles. It will help professors examine their students' prior knowledge and alternative conceptions of the chemistry concepts associated with climate science, which could then inform their teaching and instruction.

  1. Syntheses and properties of a series of novel surface active salts based on 1,4-dialkyl-1,4-diazoniabicyclo[2.2.2]octane and their supermolecular interactions with cucurbit[6]uril

    NASA Astrophysics Data System (ADS)

    Xu, Fei; Chen, Hongyu; Zhang, Haibo; Cheng, Gongzhen; Zhou, Xiaohai

    2012-06-01

    A series of novel surface active salts, 1,4-dialkyl-1,4-diazoniabicyclo[2.2.2]octane bromides (2CxDABCOBr2), have been synthesized and characterized. Their melting points show a U-shaped curve with increasing alkyl chain length, while the decomposition temperatures do not show significant differences. Critical aggregation concentration (cac) of 2C6DABCOBr2 determined by the concentration dependence of 1H NMR chemical shifts is about 100 mmol L-1, which is in good agreement with the cac obtained by electrical conductivity and surface tension measurement. The aggregation number of 2C6DABCOBr2 in aqueous solutions studied with a detailed analysis of 1H NMR is 36. The interaction between 2C6DABCOBr2 and cucurbit[6]uril in aqueous solution has also been investigated by 1H NMR and spin-lattice relaxation time measurement (T1), indicating the formation of a complex with one alkyl chain of 2C6DABCOBr2 inserted into the cavity of CB[6].

  2. Tropospheric Halogen Chemistry

    NASA Astrophysics Data System (ADS)

    von Glasow, R.; Crutzen, P. J.

    2003-12-01

    Halogens are very reactive chemicals that are known to play an important role in anthropogenic stratospheric ozone depletion chemistry, first recognized by Molina and Rowland (1974). However, they also affect the chemistry of the troposphere. They are of special interest because they are involved in many reaction cycles that can affect the oxidation power of the atmosphere indirectly by influencing the main oxidants O3 and its photolysis product OH and directly, e.g., by reactions of the Cl radical with hydrocarbons (e.g., CH4).Already by the middle of the nineteenth century, Marchand (1852) reported the presence of bromine and iodine in rain and other natural waters. He also mentions the benefits of iodine in drinking water through the prevention of goitres and cretinism. In a prophetic monograph "Air and Rain: The Beginnings of a Chemical Climatology," Smith (1872) describes measurements of chloride in rain water, which he states to originate partly from the oceans by a process that he compares with the bursting of "soap bubbles" which produces "small vehicles" that transfer small spray droplets of seawater to the air. From deviations of the sulfate-to-chloride ratio in coastal rain compared to seawater, Smith concluded that chemical processes occur once the particles are airborne.For almost a century thereafter, however, atmospheric halogens received little attention. One exception was the work by Cauer (1939), who reported that iodine pollution has been significant in Western and Central Europe due to the inefficient burning of seaweed, causing mean gas phase atmospheric concentrations as high as or greater than 0.5 μg m-3. In his classical textbook Air Chemistry and Radioactivity, Junge (1963) devoted less than three pages to halogen gas phase chemistry, discussing chlorine and iodine. As reviewed by Eriksson (1959a, b), the main atmospheric source of halogens is sea salt, derived from the bursting of bubbles of air which are produced by ocean waves and other

  3. Study of the lithiated phenylacetonitrile monoanions and dianions formed according to the lithiated base used (LHMDS, LDA, or n-BuLi). 2. Alkylation and deuteriation mechanism study by vibrational and NMR spectroscopy and quantum chemistry calculations.

    PubMed

    Strzalko, Tekla; Wartski, Lya; Corset, Jacques; Castellà-Ventura, Martine; Froment, Françoise

    2012-08-01

    Mechanisms of alkylation by PhCH(2)Cl or CH(3)I in THF and of deuteriation by DCl (4 N in D(2)O) in THF or THF-toluene of lithiated phenylacetonitrile monoanions and dianions obtained with LHMDS, LDA, or n-BuLi are studied by vibrational and NMR spectroscopy and quantum chemistry calculations. Dialkylation of the three dilithio dianions generated with n-BuLi (2.0-2.7 equiv, THF-hexane) depends on their structure: N-lithio (PhCCNLi)(-)Li(+) and (C,N)-dilithio PhCLiCNLi dianions afford PhCR(2)CN (R = PhCH(2), CH(3)) from the intermediate N-lithio monoalkylated monoanion PhCRCNLi 10; C-lithio dianion (PhCLiCN)(-)Li(+) leads to a carbenoid species, the C-lithio monoalkylated nitrile PhCLiRCN 11, which either eliminates carbene Ph-C-R and different LiCN species or isomerizes to PhCRCNLi in the presence of LiX (X = Cl, I). Dialkylation or dideuteriation of monoanions (monomers, dimers, and heterodimers [PhCHCNLi·LiR'], R' = (SiMe(3))(2)N, (i-Pr)(2)N) obtained with LHMDS or LDA (2.4 equiv, THF) proceeds via a sequential mechanism involving monometalation-monoalkylation (or monodeuteriation) reactions. Some carbene and (LiCNLi)(+) are also observed, and explained by another mechanism implying the C-lithio monoalkylated monoanion PhCLiRCN 9 in the presence of LiX. These results show the ambiphilic behavior of PhCLiRCN as a carbenoid (11) or a carbanion (9) and the importance of LiX formed in situ in the first alkylation step.

  4. Mars aqueous chemistry experiment

    NASA Technical Reports Server (NTRS)

    Clark, Benton C.; Mason, Larry W.

    1993-01-01

    The Mars Aqueous Chemistry Experiment (MACE) is designed to conduct a variety of measurements on regolith samples, encompassing mineral phase analyses, chemical interactions with H2O, and physical properties determinations. From these data, much can be learned or inferred regarding the past weathering environment, the contemporaneous soil micro-environments, and the general chemical and physical state of the Martian regolith. By analyzing both soil and duricrust samples, the nature of the latter may become more apparent. Sites may be characterized for comparative purposes and criteria could be set for selection of high priority materials on future sample return missions. Progress for the first year MACE PIDDP is reported in two major areas of effort: (1) fluids handling concepts, definition, and breadboard fabrication and (2) aqueous chemistry ion sensing technology and test facility integration. A fluids handling breadboard was designed, fabricated, and tested at Mars ambient pressure. The breadboard allows fluid manipulation scenarios to be tested under the reduced pressure conditions expected in the Martian atmosphere in order to validate valve operations, orchestrate analysis sequences, investigate sealing integrity, and to demonstrate efficacy of the fluid handling concept. Additional fluid manipulation concepts have also been developed based on updated MESUR spacecraft definition. The Mars Aqueous Chemistry Experiment Ion Selective Electrode (ISE) facility was designed as a test bed to develop a multifunction interface for measurements of chemical ion concentrations in aqueous solution. The interface allows acquisition of real time data concerning the kinetics and heats of salt dissolution, and transient response to calibration and solubility events. An array of ion selective electrodes has been interfaced and preliminary calibration studies performed.

  5. The mixed chemistry problem

    NASA Astrophysics Data System (ADS)

    Guzman-Ramirez, L.; Zijlstra, A. A.; Gesicki, K.; Lagadec, E.; Jones, D.; Millar, T. J.; Woods, P. M.; Chuimin, R. N.

    2014-04-01

    Planetary nebulae (PNe) represent the last stage of evolution of intermediate mass stars (0.8 to 8M⊙) and, hence, by their very nature are fundamental to galactic evolution. The massive envelopes ejected during their earlier evolution (AGB phase) are an important source of recycled material in the form of dust and molecular gas into the interstellar medium. A small fraction of PNe show both O- and C-rich features and are therefore classified as mixed-chemistry objects. The origin of their mixed-chemistry is still uncertain. Our chemical models show that the PAHs may form in irradiated dense tori, and HST images confirm the presence of such tori in some of the objects. Using the VISIR/VLT, we spatially resolved the precise location of the PAHs. We find a dense dusty structures in all of the objects observed. The ionised [SIV] material is located inside the dusty tori, while the PAHs are present at the outer edges of these tori. This confirms that the PAHs formation is due to the photodissociation of CO. In the Galactic Disk, very few PNe have shown to harbour these mixed-chemistry phenomenon. We propose to observe the tori of a sample of bipolar PNe from the Galactic Disk that harbour a close binary system inside them. The chemical models show that the formation of long C-chain molecules is possible to occur in O-rich environments, but the formation of these C-rich molecules require a very dense region (Av˜4). To test this theory we propose to observe the very dense tori of these Galactic Disk PNe and compare these sample with the already observed sample of PNe in the Galactic Bulge (Guzman-Ramirez, et al., 2011;Guzman-Ramirez, et al., 2013, submitted).

  6. Extended Wordsearches in Chemistry

    NASA Astrophysics Data System (ADS)

    Cotton, Simon

    1998-04-01

    Students can be encouraged to develop their factual knowledge by use of puzzles. One strategy described here is the extended wordsearch, where the wordsearch element generates a number of words or phrases from which the answers to a series of questions are selected. The wordsearch can be generated with the aid of computer programs, though in order to make them suitable for students with dyslexia or other learning difficulties, a simpler form is more appropriate. These problems can be employed in a variety of contexts, for example, as topic tests and classroom end-of-lesson fillers. An example is provided in the area of calcium chemistry. Sources of suitable software are listed.

  7. Dynamic foldamer chemistry.

    PubMed

    Le Bailly, Bryden A F; Clayden, Jonathan

    2016-04-01

    Foldamers can be made more than pieces of static, conformationally uniform molecular architecture by designing into their structure the conformational dynamism characteristic of functional molecular machines. We show that these dynamic foldamers display biomimetic properties reminiscent of allosteric proteins and receptor molecules. They can translate chemical signals into conformational changes, and hence into chemical outputs such as control of reactivity and selectivity. Future developments could see dynamic foldamers operating in the membrane phase providing artificial mechanisms for communication and control that integrate synthetic chemistry into synthetic biology. PMID:26955864

  8. Chemistry and selection.

    PubMed

    de Duve, Christian

    2007-04-01

    Life is the product of chemistry, which obeys deterministic laws, and of natural selection, which operates on variants offered to it by chance, but may, in a number of cases, have been provided with a sufficiently extensive array of variants to be optimizing. Thus, the origin and evolution of life have been largely shaped by the contingency of environmental conditions. The possibility remaining open for consideration is that certain critical conditions are sufficiently reproducible for life to arise and even to evolve into conscious, intelligent beings elsewhere in the universe.

  9. Sustainable chemistry metrics.

    PubMed

    Calvo-Flores, Francisco García

    2009-01-01

    Green chemistry has developed mathematical parameters to describe the sustainability of chemical reactions and processes, in order to quantify their environmental impact. These parameters are related to mass and energy magnitudes, and enable analyses and numerical diagnoses of chemical reactions. The environmental impact factor (E factor), atom economy, and reaction mass efficiency have been the most influential metrics, and they are interconnected by mathematical equations. The ecodesign concept must also be considered for complex industrial syntheses, as a part of the sustainability of manufacturing processes. The aim of this Concept article is to identify the main parameters for evaluating undesirable environmental consequences. PMID:19780101

  10. Phoenix's Wet Chemistry Lab

    NASA Technical Reports Server (NTRS)

    2008-01-01

    This is an illustration of soil analysis on NASA's Phoenix Mars Lander's Wet Chemistry Lab (WCL) on board the Microscopy, Electrochemistry, and Conductivity Analyzer (MECA) instrument. By dissolving small amounts of soil in water, WCL will attempt to determine the pH, the abundance of minerals such as magnesium and sodium cations or chloride, bromide and sulfate anions, as well as the conductivity and redox potential.

    The Phoenix Mission is led by the University of Arizona, Tucson, on behalf of NASA. Project management of the mission is by NASA's Jet Propulsion Laboratory, Pasadena, Calif. Spacecraft development is by Lockheed Martin Space Systems, Denver.

  11. Phoenix's Wet Chemistry Lab

    NASA Technical Reports Server (NTRS)

    2008-01-01

    This is an illustration of the analytical procedure of NASA's Phoenix Mars Lander's Wet Chemistry Lab (WCL) on board the Microscopy, Electrochemistry, and Conductivity Analyzer (MECA) instrument. By dissolving small amounts of soil in water, WCL can determine the pH, the abundance of minerals such as magnesium and sodium cations or chloride, bromide and sulfate anions, as well as the conductivity and redox potential.

    The Phoenix Mission is led by the University of Arizona, Tucson, on behalf of NASA. Project management of the mission is by NASA's Jet Propulsion Laboratory, Pasadena, Calif. Spacecraft development is by Lockheed Martin Space Systems, Denver.

  12. Chemistry and Science Fiction

    NASA Astrophysics Data System (ADS)

    Stocker, Jack H.

    1998-11-01

    This lively collection looks at science as filtered through literature, film, and television. It discusses classic works in science fiction and provides an in-depth look at the chemistry depicted in popular culture, particularly in Start Trek , Star Wars , and Doctor Who . It includes an examination by Nebula Award winner Connie Willis of how science fiction authors use science, and reprints two tongue-in-cheek short stories by Isaac Asimov. The book also includes suggestions for using science fiction as an educational resource.

  13. Solvents and sustainable chemistry

    PubMed Central

    Welton, Tom

    2015-01-01

    Solvents are widely recognized to be of great environmental concern. The reduction of their use is one of the most important aims of green chemistry. In addition to this, the appropriate selection of solvent for a process can greatly improve the sustainability of a chemical production process. There has also been extensive research into the application of so-called green solvents, such as ionic liquids and supercritical fluids. However, most examples of solvent technologies that give improved sustainability come from the application of well-established solvents. It is also apparent that the successful implementation of environmentally sustainable processes must be accompanied by improvements in commercial performance. PMID:26730217

  14. Green chemistry: principles and practice.

    PubMed

    Anastas, Paul; Eghbali, Nicolas

    2010-01-01

    Green Chemistry is a relatively new emerging field that strives to work at the molecular level to achieve sustainability. The field has received widespread interest in the past decade due to its ability to harness chemical innovation to meet environmental and economic goals simultaneously. Green Chemistry has a framework of a cohesive set of Twelve Principles, which have been systematically surveyed in this critical review. This article covers the concepts of design and the scientific philosophy of Green Chemistry with a set of illustrative examples. Future trends in Green Chemistry are discussed with the challenge of using the Principles as a cohesive design system (93 references). PMID:20023854

  15. Cross-Connections of Chemistry

    NASA Astrophysics Data System (ADS)

    Mason, Diana S.

    2002-02-01

    We are in desperate need of qualified chemistry teachers. Are the teachers who have biology, physics, or some psychology degrees qualified to teach chemistry? Have they taken enough chemistry to be prepared to teach outside their degree field? If remediation is necessary, what courses should be required? Attracting pre-service science teachers to the study of pure chemistry is not an easy task when more attractive course offerings are available. Maybe we should concentrate on cross-training in-service teachers by providing appropriate graduate courses to encourage them and bring them into the family. Many teachers with degrees outside the traditional discipline of chemistry have adequate backgrounds in the applications of chemistry. Requiring hours of undergraduate education before they enter the hallowed halls of the chemistry building as graduate students only serves to discourage a large segment of in-service teachers who wish to broaden their perspective. The National Science Education Standards make a compelling argument for connecting and integrating science courses for practicing teachers (3). We are at the crossroads. At a time when we so desperately need qualified chemistry teachers, shouldn't we be more open in our graduate teaching programs, inviting those with degrees in other disciplines to start on a graduate degree without insisting on undergraduate or survey coursework first? Many potential chemical education graduate students have a background in chemistry--it is just known by another name.

  16. Clinical chemistry of thiamin.

    PubMed

    Davis, R E; Icke, G C

    1983-01-01

    This volume covers the history of thiamin, its chemistry and biochemistry, methods for the assessment of thiamin status, and the clinical chemistry of thiamin. Thiamin plays an essential role in carbohydrate metabolism, and there is some evidence it may also affect protein and lipid biosynthesis. Thiamin is composed of pyrimidine and thiazole moieties that are joined by a methylene bridge. The daily requirement of thiamin is related to energy need, especially that which is derived from carbohydrate. 0.33 mg of thiamin is required for each 4400 kJ of energy requirement; thus, a thiamin intake of 0.5 mg/4400 kJ has been recommended for adults and children of all ages. Measurement of blood levels, the excretion rate of the vitamin, the abnormal metabolic products resulting from a deficient state, or some other product dependent on the concentration of the vitamin in the body have been used to assess thiamin status. Clinical states that may be associated with a change in thiamin status include Wernicke-Korsakoff syndrome, subacute necrotizing encephalomyelopathy, megablastic anemia, maple syrup urine disease, and beriberi. There is no evidence that oral contraceptives have an adverse effect on thiamin metabolism. There is an increased requirement for thiamin during pregnancy, which may result in a deficiency in the mother. Moreover, thiamin deficiency has been implicated as a factor in toxemia of pregnancy. The concentration of thiamin in human breast milk is related to maternal intake of the vitamin, and cow's milk contains considerably more thiamin than human milk.

  17. Current ADC Linker Chemistry.

    PubMed

    Jain, Nareshkumar; Smith, Sean W; Ghone, Sanjeevani; Tomczuk, Bruce

    2015-11-01

    The list of ADCs in the clinic continues to grow, bolstered by the success of first two marketed ADCs: ADCETRIS® and Kadcyla®. Currently, there are 40 ADCs in various phases of clinical development. However, only 34 of these have published their structures. Of the 34 disclosed structures, 24 of them use a linkage to the thiol of cysteines on the monoclonal antibody. The remaining 10 candidates utilize chemistry to surface lysines of the antibody. Due to the inherent heterogeneity of conjugation to the multiple lysines or cysteines found in mAbs, significant research efforts are now being directed toward the production of discrete, homogeneous ADC products, via site-specific conjugation. These site-specific conjugations may involve genetic engineering of the mAb to introduce discrete, available cysteines or non-natural amino acids with an orthogonally-reactive functional group handle such as an aldehyde, ketone, azido, or alkynyl tag. These site-specific approaches not only increase the homogeneity of ADCs but also enable novel bio-orthogonal chemistries that utilize reactive moieties other than thiol or amine. This broadens the diversity of linkers that can be utilized which will lead to better linker design in future generations of ADCs.

  18. Complex Protostellar Chemistry

    NASA Technical Reports Server (NTRS)

    Nuth, Joseph A., III; Johnson, Natasha M.

    2012-01-01

    Two decades ago, our understanding of the chemistry in protostars was simple-matter either fell into the central star or was trapped in planetary-scale objects. Some minor chemical changes might occur as the dust and gas fell inward, but such effects were overwhelmed by the much larger scale processes that occurred even in bodies as small as asteroids. The chemistry that did occur in the nebula was relatively easy to model because the fall from the cold molecular cloud into the growing star was a one-way trip down a well-known temperature-pressure gradient; the only free variable was time. However, just over 10 years ago it was suggested that some material could be processed in the inner nebula, flow outward, and become incorporated into comets (1, 2). This outward flow was confirmed when the Stardust mission returned crystalline mineral fragments (3) from Comet Wild 2 that must have been processed close to the Sun before they were incorporated into the comet. In this week's Science Express, Ciesla and Sandford (4) demonstrate that even the outermost regions of the solar nebula can be a chemically active environment. Their finding could have consequences for the rest of the nebula.

  19. Influencing College Chemistry Success through High School Chemistry Teaching

    ERIC Educational Resources Information Center

    Tai, Robert H.; Sadler, Philip M.; Loehr, John F.

    2006-01-01

    The connection between high school chemistry pedagogical experiences and introductory college chemistry performance has been a topic researched in published science education literature since the 1920s. However, analysis techniques have limited the generalizability of these results. This review discusses the findings of a large-scale,…

  20. An Exhibition on Everyday Chemistry. Communicating Chemistry to the Public.

    ERIC Educational Resources Information Center

    Ucko, David A.; And Others

    1986-01-01

    Discusses a recent addition to the Museum of Science and Industry (Chicago) known as "Everyday Chemistry." This permanent exhibit on modern chemistry incorporates demonstrations of chemical reactions in ways intended to enhance public understanding. Describes the six cases in the exhibit and the automated aspects of their demonstrations. (TW)

  1. Art in Chemistry: Chemistry in Art. Second Edition

    ERIC Educational Resources Information Center

    Greenberg, Barbara R.; Patterson, Dianne

    2008-01-01

    This textbook integrates chemistry and art with hands-on activities and fascinating demonstrations that enable students to see and understand how the science of chemistry is involved in the creation of art. It investigates such topics as color integrated with electromagnetic radiation, atoms, and ions; paints integrated with classes of matter,…

  2. A New Chemistry Course for Non-Chemistry Majors.

    ERIC Educational Resources Information Center

    Ariel, Magda; And Others

    1982-01-01

    A two-semester basic chemistry course for nonchemistry engineering majors is described. First semester provides introductory chemistry for freshmen while second semester is "customer-oriented," based on a departmental choice of three out of six independent modules. For example, aeronautical engineering "customers" would select kinetics, organic…

  3. A Quantum Chemistry Concept Inventory for Physical Chemistry Classes

    ERIC Educational Resources Information Center

    Dick-Perez, Marilu; Luxford, Cynthia J.; Windus, Theresa L.; Holme, Thomas

    2016-01-01

    A 14-item, multiple-choice diagnostic assessment tool, the quantum chemistry concept inventory or QCCI, is presented. Items were developed based on published student misconceptions and content coverage and then piloted and used in advanced physical chemistry undergraduate courses. In addition to the instrument itself, data from both a pretest,…

  4. Introducing Chemistry Students to the "Real World" of Chemistry

    ERIC Educational Resources Information Center

    Brown, Michael E.; Cosser, Ronald C.; Davies-Coleman, Michael T.; Kaye, Perry T.; Klein, Rosalyn; Lamprecht, Emmanuel; Lobb, Kevin; Nyokong, Tebello; Sewry, Joyce D.; Tshentu, Zenixole R.; van der Zeyde, Tino; Watkins, Gareth M.

    2010-01-01

    A majority of chemistry graduates seek employment in a rapidly changing chemical industry. Our attempts to provide the graduates with skills in entrepreneurship and the ability to understand and communicate with their chemical engineering colleagues, in addition to their fundamental knowledge of chemistry, are described. This is done at…

  5. Green Chemistry Metrics with Special Reference to Green Analytical Chemistry.

    PubMed

    Tobiszewski, Marek; Marć, Mariusz; Gałuszka, Agnieszka; Namieśnik, Jacek

    2015-01-01

    The concept of green chemistry is widely recognized in chemical laboratories. To properly measure an environmental impact of chemical processes, dedicated assessment tools are required. This paper summarizes the current state of knowledge in the field of development of green chemistry and green analytical chemistry metrics. The diverse methods used for evaluation of the greenness of organic synthesis, such as eco-footprint, E-Factor, EATOS, and Eco-Scale are described. Both the well-established and recently developed green analytical chemistry metrics, including NEMI labeling and analytical Eco-scale, are presented. Additionally, this paper focuses on the possibility of the use of multivariate statistics in evaluation of environmental impact of analytical procedures. All the above metrics are compared and discussed in terms of their advantages and disadvantages. The current needs and future perspectives in green chemistry metrics are also discussed. PMID:26076112

  6. Green Chemistry Metrics with Special Reference to Green Analytical Chemistry.

    PubMed

    Tobiszewski, Marek; Marć, Mariusz; Gałuszka, Agnieszka; Namieśnik, Jacek

    2015-06-12

    The concept of green chemistry is widely recognized in chemical laboratories. To properly measure an environmental impact of chemical processes, dedicated assessment tools are required. This paper summarizes the current state of knowledge in the field of development of green chemistry and green analytical chemistry metrics. The diverse methods used for evaluation of the greenness of organic synthesis, such as eco-footprint, E-Factor, EATOS, and Eco-Scale are described. Both the well-established and recently developed green analytical chemistry metrics, including NEMI labeling and analytical Eco-scale, are presented. Additionally, this paper focuses on the possibility of the use of multivariate statistics in evaluation of environmental impact of analytical procedures. All the above metrics are compared and discussed in terms of their advantages and disadvantages. The current needs and future perspectives in green chemistry metrics are also discussed.

  7. Significant steps in the evolution of analytical chemistry--is the today's analytical chemistry only chemistry?

    PubMed

    Karayannis, Miltiades I; Efstathiou, Constantinos E

    2012-12-15

    In this review the history of chemistry and specifically the history and the significant steps of the evolution of analytical chemistry are presented. In chronological time spans, covering the ancient world, the middle ages, the period of the 19th century, and the three evolutional periods, from the verge of the 19th century to contemporary times, it is given information for the progress of chemistry and analytical chemistry. During this period, analytical chemistry moved gradually from its pure empirical nature to more rational scientific activities, transforming itself to an autonomous branch of chemistry and a separate discipline. It is also shown that analytical chemistry moved gradually from the status of exclusive serving the chemical science, towards serving, the environment, health, law, almost all areas of science and technology, and the overall society. Some recommendations are also directed to analytical chemistry educators concerning the indispensable nature of knowledge of classical analytical chemistry and the associated laboratory exercises and to analysts, in general, why it is important to use the chemical knowledge to make measurements on problems of everyday life.

  8. Chemistry laboratory safety manual available

    NASA Technical Reports Server (NTRS)

    Elsbrock, R. G.

    1968-01-01

    Chemistry laboratory safety manual outlines safe practices for handling hazardous chemicals and chemistry laboratory equipment. Included are discussions of chemical hazards relating to fire, health, explosion, safety equipment and procedures for certain laboratory techniques and manipulations involving glassware, vacuum equipment, acids, bases, and volatile solvents.

  9. Organic Chemistry for the Gifted.

    ERIC Educational Resources Information Center

    deBeer, W. H. J.

    In response to a serious shortage of chemists in South Africa, gifted secondary school students are enrolled in an enrichment program in organic chemistry and encouraged to consider chemistry or one of its related fields as a career. The introductory portion of the program involves approximately 90 hours over a 3-year period while the advanced…

  10. Chemical Principles Revisited: Petroleum Chemistry.

    ERIC Educational Resources Information Center

    Kolb, Doris; Kolb, Kenneth E.

    1979-01-01

    Presents an historical review of the role of petroleum in world history and information on the chemistry of petroleum. It is suggested that petroleum chemistry be discussed since within the next two decades oil and gas will provide the major portion of U.S. energy. (Author/SA)

  11. Creating a Context for Chemistry.

    ERIC Educational Resources Information Center

    Schwartz, A. Truman

    1999-01-01

    Summarizes the origin, development, content, pedagogy, evaluation, and influence of a textbook for non-science majors entitled "Chemistry in Context: Applying Chemistry to Society." Considers the text's potential implications for other disciplines and for the instruction of science majors. (Author/WRM)

  12. Contextualising Nanotechnology in Chemistry Education

    ERIC Educational Resources Information Center

    O'Connor, Christine; Hayden, Hugh

    2008-01-01

    In recent years nanotechnology has become part of the content of many undergraduate chemistry and physics degree courses. This paper deals with the role of contextualisation of nanotechnology in the delivery of the content, as nanotechnology is only now being slowly integrated into many chemistry degree courses in Ireland and elsewhere. An…

  13. Crocodile Chemistry. [CD-ROM].

    ERIC Educational Resources Information Center

    1999

    This high school chemistry resource is an on-screen chemistry lab. In the program, students can experiment with a huge range of chemicals, choosing the form, quantity and concentrations. Dangerous or difficult experiments can be investigated safely and easily. A vast range of equipment can be set up, and complex simulations can be put together and…

  14. A Chemistry Concept Reasoning Test

    ERIC Educational Resources Information Center

    Cloonan, Carrie A.; Hutchinson, John S.

    2011-01-01

    A Chemistry Concept Reasoning Test was created and validated providing an easy-to-use tool for measuring conceptual understanding and critical scientific thinking of general chemistry models and theories. The test is designed to measure concept understanding comparable to that found in free-response questions requiring explanations over…

  15. News from Online: Green Chemistry

    ERIC Educational Resources Information Center

    Uffelman, Erich S.

    2004-01-01

    Green chemistry closely relates to energy and environmental problems, and includes the promotion of environmental friendly products and systems within the framework of renewable resources. Various websites on green chemistry are reviewed, one of which lists the 12 commandments of this particular subject.

  16. Plasma chemistry and its applications

    NASA Technical Reports Server (NTRS)

    Hozumi, K.

    1980-01-01

    The relationship between discharge phenomena and plasma chemistry, as well as the equipment and mechanisms of plasma chemical reactions are described. Various areas in which plasma chemistry is applied are surveyed, such as: manufacturing of semiconductor integrated circuits; synthetic fibers; high polymer materials for medical uses; optical lenses; and membrane filters (reverse penetration films).

  17. The Great Ideas of Chemistry.

    ERIC Educational Resources Information Center

    Gillespie, Ronald J.

    1997-01-01

    Presents a list of six concepts that form the basis of modern chemistry and that should be included in introductory chemistry courses. Discusses atoms, molecules, and ions; the chemical bond; molecular shape and geometry; kinetic theory; the chemical reaction; and energy and entropy. (JRH)

  18. Fundamentals of Aqueous Microwave Chemistry

    EPA Science Inventory

    The first chemical revolution changed modern life with a host of excellent amenities and services, but created serious problems related to environmental pollution. After 150 years of current chemistry principles and practices, we need a radical change to a new type of chemistry k...

  19. Remedial Mathematics for Quantum Chemistry

    ERIC Educational Resources Information Center

    Koopman, Lodewijk; Brouwer, Natasa; Heck, Andre; Buma, Wybren Jan

    2008-01-01

    Proper mathematical skills are important for every science course and mathematics-intensive chemistry courses rely on a sound mathematical pre-knowledge. In the first-year quantum chemistry course at this university, it was noticed that many students lack basic mathematical knowledge. To tackle the mathematics problem, a remedial mathematics…

  20. Rethinking Undergraduate Physical Chemistry Curricula

    ERIC Educational Resources Information Center

    Miller, Stephen R.

    2016-01-01

    A summary of fundamental changes made to the undergraduate physical chemistry curriculum in the Chemistry Department at Gustavus Adolphus College (beginning in the 2013-2014 academic year) is presented. The yearlong sequence now consists of an introductory semester covering both quantum mechanics and thermodynamics/kinetics, followed by a second…

  1. [Photonic crystals for analytical chemistry].

    PubMed

    Chen, Yi; Li, Jincheng

    2009-09-01

    Photonic crystals, originally created to control the transmission of light, have found their increasing value in the field of analytical chemistry and are probable to become a hot research area soon. This review is hence composed, focusing on their analytical chemistry-oriented applications, including especially their use in chromatography, capillary- and chip-based electrophoresis.

  2. Stereochemical Control in Carbohydrate Chemistry

    ERIC Educational Resources Information Center

    Batchelor, Rhys; Northcote, Peter T.; Harvey, Joanne E.; Dangerfield, Emma M.; Stocker, Bridget L.

    2008-01-01

    Carbohydrates, in the form of glycoconjugates, have recently been shown to control a wide range of cellular processes. Accordingly, students interested in the study of organic chemistry and biomedical sciences should be exposed to carbohydrate chemistry. To this end, we have developed a sequence of experiments that leads the student from the…

  3. Introducing Relativity into Quantum Chemistry

    ERIC Educational Resources Information Center

    Li, Wai-Kee; Blinder, S. M.

    2011-01-01

    It is not often realized by chemists that the special theory of relativity is behind several aspects of quantum chemistry. The Schrdinger equation itself is based on relations between space-time and energy-momentum four vectors. Electron spin is, of course, the most obvious manifestation of relativity. The chemistry of some heavy elements is…

  4. Chemistry Teachers' Views of Creativity

    ERIC Educational Resources Information Center

    Akkanat, Çigdem; Gökdere, Murat

    2015-01-01

    The purpose of this study was to determine chemistry teachers' views of creativity. In this study, phenomenology method, one of the qualitative research patterns, was used. The participants of this study were 13 chemistry teachers working in Amasya. A semi-structured interview form was used for data collection. By using NVivo 9 qualitative…

  5. Local Evaluation of Chemistry Journals

    ERIC Educational Resources Information Center

    Kraus, Joseph R.; Hansen, Rachel

    2008-01-01

    This paper reports on the evaluation of local usage statistics of a specific set of chemistry journals at the University of Denver in Colorado, USA. The objective of the study is to demonstrate that commercial publishers in chemistry charge considerably more for their journals than those from the non-commercial sector. There are three variables…

  6. Organic chemistry on Titan

    NASA Technical Reports Server (NTRS)

    Chang, S.; Scattergood, T.; Aronowitz, S.; Flores, J.

    1979-01-01

    Features taken from various models of Titan's atmosphere are combined in a working composite model that provides environmental constraints within which different pathways for organic chemical synthesis are determined. Experimental results and theoretical modeling suggest that the organic chemistry of the satellite is dominated by two processes: photochemistry and energetic particle bombardment. Photochemical reactions of CH4 in the upper atmosphere can account for the presence of C2 hydrocarbons. Reactions initiated at various levels of the atmosphere by cosmic rays, Saturn 'wind', and solar wind particle bombardment of a CH4-N2 atmospheric mixture can account for the UV-visible absorbing stratospheric haze, the reddish appearance of the satellite, and some of the C2 hydrocarbons. In the lower atmosphere photochemical processes will be important if surface temperatures are sufficiently high for gaseous NH3 to exist. It is concluded that the surface of Titan may contain ancient or recent organic matter (or both) produced in the atmosphere.

  7. Nanoplasmonics tuned "click chemistry".

    PubMed

    Tijunelyte, I; Guenin, E; Lidgi-Guigui, N; Colas, F; Ibrahim, J; Toury, T; Lamy de la Chapelle, M

    2016-04-01

    Nanoplasmonics is a growing field of optical condensed matter science dedicated to optical phenomena at the nanoscale level in metal systems. Extensive research on noble metallic nanoparticles (NPs) has emerged within the last two decades due to their ability to keep the optical energy concentrated in the vicinity of NPs, in particular, the ability to create optical near-field enhancement followed by heat generation. We have exploited these properties in order to induce a localised "click" reaction in the vicinity of gold nanostructures under unfavourable experimental conditions. We demonstrate that this reaction can be controlled by the plasmonic properties of the nanostructures and we propose two physical mechanisms to interpret the observed plasmonic tuning of the "click" chemistry.

  8. Prebiotic phosphorus chemistry reconsidered

    NASA Technical Reports Server (NTRS)

    Schwartz, A. W.; Orgel, L. E. (Principal Investigator)

    1997-01-01

    The available evidence indicates that the origin of life on Earth certainly occurred earlier than 3.5 billion years ago and perhaps substantially earlier. The time available for the chemical evolution which must have preceded this event is more difficult to estimate. Both endogenic and exogenic contributions to chemical evolution have been considered; i.e., from chemical reactions in a primitive atmosphere, or by introduction in the interiors of comets and/or meteorites. It is argued, however, that the phosphorus chemistry of Earth's earliest hydrosphere, whether primarily exogenic or endogenic in origin, was most likely dominated by compounds less oxidized than phosphoric acid and its esters. A scenario is presented for the early production of a suite of reactive phosphonic acid derivatives, the properties of which may have foreshadowed the later appearance of biophosphates.

  9. Advances in analytical chemistry

    NASA Technical Reports Server (NTRS)

    Arendale, W. F.; Congo, Richard T.; Nielsen, Bruce J.

    1991-01-01

    Implementation of computer programs based on multivariate statistical algorithms makes possible obtaining reliable information from long data vectors that contain large amounts of extraneous information, for example, noise and/or analytes that we do not wish to control. Three examples are described. Each of these applications requires the use of techniques characteristic of modern analytical chemistry. The first example, using a quantitative or analytical model, describes the determination of the acid dissociation constant for 2,2'-pyridyl thiophene using archived data. The second example describes an investigation to determine the active biocidal species of iodine in aqueous solutions. The third example is taken from a research program directed toward advanced fiber-optic chemical sensors. The second and third examples require heuristic or empirical models.

  10. Atmospheric Pseudohalogen Chemistry

    NASA Technical Reports Server (NTRS)

    Lary, David John

    2004-01-01

    Hydrogen cyanide is not usually considered in atmospheric chemical models. The paper presents three reasons why hydrogen cyanide is likely to be significant for atmospheric chemistry. Firstly, HCN is a product and marker of biomass burning. Secondly, it is also likely that lightning is producing HCN, and as HCN is sparingly soluble it could be a useful long-lived "smoking gun" marker of lightning activity. Thirdly, the chemical decomposition of HCN leads to the production of small amounts of the cyanide (CN) and NCO radicals. The NCO radical can be photolyzed in the visible portion of the spectrum yielding nitrogen atoms (N). The production of nitrogen atoms is significant as it leads to the titration of total nitrogen from the atmosphere via N+N->N2, where N2 is molecular nitrogen.

  11. Automation in medicinal chemistry.

    PubMed

    Reader, John C

    2004-01-01

    The implementation of appropriate automation can make a significant improvement in productivity at each stage of the drug discovery process, if it is incorporated into an efficient overall process. Automated chemistry has evolved rapidly from the 'combinatorial' techniques implemented in many industrial laboratories in the early 1990's which focused primarily on the hit discovery phase, and were highly dependent on solid-phase techniques and instrumentation derived from peptide synthesis. Automated tools and strategies have been developed which can impact the hit discovery, hit expansion and lead optimization phases, not only in synthesis, but also in reaction optimization, work-up, and purification of compounds. This article discusses the implementation of some of these techniques, based especially on experiences at Millennium Pharmaceuticals Research and Development Ltd.

  12. Chemistry of Aviation Fuels

    NASA Technical Reports Server (NTRS)

    Knepper, Bryan; Hwang, Soon Muk; DeWitt, Kenneth J.

    2004-01-01

    Minimum ignition energies of various methanol/air mixtures were measured in a temperature controlled constant volume combustion vessel using a spark ignition method with a spark gap distance of 2 mm. The minimum ignition energies decrease rapidly as the mixture composition (equivalence ratio, Phi) changes from lean to stoichiometric, reach a minimum value, and then increase rather slowly with Phi. The minimum of the minimum ignition energy (MIE) and the corresponding mixture composition were determined to be 0.137 mJ and Phi = 1.16, a slightly rich mixture. The variation of minimum ignition energy with respect to the mixture composition is explained in terms of changes in reaction chemistry.

  13. Agricultural chemistry and bioenergy.

    PubMed

    Orts, William J; Holtman, Kevin M; Seiber, James N

    2008-06-11

    Renewed interest in converting biomass to biofuels such as ethanol, other forms of bioenergy, and bioenergy byproducts or coproducts of commercial value opens opportunities for chemists, including agricultural chemists and related disciplines. Applications include feedstock characterization and quantification of structural changes resulting from genetic modification and of the intermediates formed during enzymatic and chemical processing; development of improved processes for utilizing chemical coproducts such as lactic acid and glycerol; development of alternative biofuels such as methanol, butanol, and hydrogen; and ways to reduce greenhouse gas emission and/or use carbon dioxide beneficially. Chemists will also be heavily involved in detailing the phytochemical composition of alternative energy crops and genetically improved crops. A resurgence of demand for agricultural chemistry and related disciplines argues for increasing output through targeted programs and on-the-job training. PMID:18473470

  14. Prebiotic chemistry in clouds

    NASA Technical Reports Server (NTRS)

    Oberbeck, Verne R.; Marshall, John; Shen, Thomas

    1991-01-01

    The chemical evolution hypothesis of Woese (1979), according to which prebiotic reactions occurred rapidly in droplets in giant atmospheric reflux columns was criticized by Scherer (1985). This paper proposes a mechanism for prebiotic chemistry in clouds that answers Scherer's concerns and supports Woese's hypothesis. According to this mechanism, rapid prebiotic chemical evolution was facilitated on the primordial earth by cycles of condensation and evaporation of cloud drops containing clay condensation nuclei and nonvolatile monomers. For example, amino acids supplied by, or synthesized during entry of meteorites, comets, and interplanetary dust, would have been scavenged by cloud drops containing clay condensation nuclei and would be polymerized within cloud systems during cycles of condensation, freezing, melting, and evaporation of cloud drops.

  15. Complex Autocatalysis in Simple Chemistries.

    PubMed

    Virgo, Nathaniel; Ikegami, Takashi; McGregor, Simon

    2016-01-01

    Life on Earth must originally have arisen from abiotic chemistry. Since the details of this chemistry are unknown, we wish to understand, in general, which types of chemistry can lead to complex, lifelike behavior. Here we show that even very simple chemistries in the thermodynamically reversible regime can self-organize to form complex autocatalytic cycles, with the catalytic effects emerging from the network structure. We demonstrate this with a very simple but thermodynamically reasonable artificial chemistry model. By suppressing the direct reaction from reactants to products, we obtain the simplest kind of autocatalytic cycle, resulting in exponential growth. When these simple first-order cycles are prevented from forming, the system achieves superexponential growth through more complex, higher-order autocatalytic cycles. This leads to nonlinear phenomena such as oscillations and bistability, the latter of which is of particular interest regarding the origins of life.

  16. Chemistry of Art and Color Sudoku Puzzles

    ERIC Educational Resources Information Center

    Welsh, Michael J.

    2007-01-01

    Sudoku puzzle format was used to teach light science and chemistry terms to students of Chemistry of Art and Color. The puzzles were used to motivate and encourage students to learn chemistry in an easier and in friendly fashion.

  17. Molecular and crystal structures of dialkylated adenines ( N6, N9-Me 2Ade, N3, N6-MeBnAde) and cytosines ( N1, N4-Me 2Cyt)

    NASA Astrophysics Data System (ADS)

    Krüger, Thomas; Wagner, Christoph; Bruhn, Clemens; Lis, Tadeusz; Steinborn, Dirk

    2008-11-01

    N6, N9-Dimethyladenine ( N6, N9-Me 2Ade, 1) and N1, N4-dimethylcytosine ( N1, N4-Me 2Cyt, 3) were obtained by conventional methods, whereas the reaction of N6-benzyladenine with MeI/NaOH resulted in the formation of N3, N6-MeBnAde ( 2a) and N6, N9-BnMeAde ( 2b). All compounds were fully characterized by microanalysis, NMR spectroscopy ( 1H, 13C) and 1, 2a·2MeOH and 3 also by single-crystal X-ray diffraction analyses. In single-crystals of 1, obtained from THF solutions, twofold N6-H···N7' hydrogen-bonded dimeric units ( N6, N9-Me 2Ade) 2 (AA1 2 type according to Jeffrey and Saenger, 1991) were found. This proved to be another modification than that obtained by crystallization N6, N9-Me 2Ade from MeOH/PhCl (Sternglanz, 1978). Crystals of 2a·2MeOH exhibited an analogous hydrogen bond pattern as found in 1. The shorter N6···N7' distance in 2a·2MeOH (2.932(2) Å) indicates slightly stronger hydrogen bonds than in 1 (3.078(3) Å). Crystals of 3 are built up from centrosymmetric dimers ( N1, N4-Me 2Cyt) 2 having a twofold N4-H···N3' hydrogen bond, thus exhibiting the CC3 2 hydrogen bond pattern. The hydrogen bonding patterns in the dialkylated nucleobase derivatives are discussed in terms of those found in crystals of the less substituted nucleobases N9-MeAde and Cyt/ N1-MeCyt, respectively.

  18. Stereospecific ligands and their complexes. Part XII. Synthesis, characterization and in vitro antiproliferative activity of platinum(IV) complexes with some O,O‧-dialkyl esters of (S,S)-ethylenediamine-N,N‧-di-2-propanoic acid against colon cancer (HCT-116) and breast cancer (MDA-MB-231) cell lines

    NASA Astrophysics Data System (ADS)

    Stojković, Danijela Lj.; Jevtić, Verica V.; Radić, Gordana P.; Đačić, Dragana S.; Ćurčić, Milena G.; Marković, Snežana D.; Ðinović, Vesna M.; Petrović, Vladimir P.; Trifunović, Srećko R.

    2014-03-01

    Synthesis of three new platinum(IV) complexes C1-C3, with bidentate N,N‧-ligand precursors, O,O‧-dialkyl esters (alkyl = propyl, butyl and pentyl), of (S,S)-ethylenediamine-N,N‧-di-2-propanoic acid, H2-S,S-eddp were reported. The reported platinum(IV) complexes characterized by elemental analysis and their structures were discussed on the bases of their infrared, 1H and 13C NMR spectroscopy. In vitro antiproliferative activity was determined on tumor cell lines: human colon carcinoma HCT-116 and human breast carcinoma MDA-MB-231, using MTT test.

  19. Prebiotic chemistry in clouds.

    PubMed

    Oberbeck, V R; Marshall, J; Shen, T

    1991-01-01

    In the traditional concept for the origin of life as proposed by Oparin and Haldane in the 1920s, prebiotic reactants became slowly concentrated in the primordial oceans and life evolved slowly from a series of highly protracted chemical reactions during the first billion years of Earth's history. However, chemical evolution may not have occurred continuously because planetesimals and asteroids impacted the Earth many times during the first billion years, may have sterilized the Earth, and required the process to start over. A rapid process of chemical evolution may have been required in order that life appeared at or before 3.5 billion years ago. Thus, a setting favoring rapid chemical evolution may be required. A chemical evolution hypothesis set forth by Woese in 1979 accomplished prebiotic reactions rapidly in droplets in giant atmospheric reflux columns. However, in 1985 Scherer raised a number of objections to Woese's hypothesis and concluded that it was not valid. We propose a mechanism for prebiotic chemistry in clouds that satisfies Scherer's concerns regarding the Woese hypothesis and includes advantageous droplet chemistry. Prebiotic reactants were supplied to the atmosphere by comets, meteorites, and interplanetary dust or synthesized in the atmosphere from simple compounds using energy sources such as ultraviolet light, corona discharge, or lightning. These prebiotic monomers would have first encountered moisture in cloud drops and precipitation. We propose that rapid prebiotic chemical evolution was facilitated on the primordial Earth by cycles of condensation and evaporation of cloud drops containing clay condensation nuclei and nonvolatile monomers. For example, amino acids supplied by , or synthesized during entry of, meteorites, comets, and interplanetary dust would have been scavenged by cloud drops containing clay condensation nuclei. Polymerization would have occurred within cloud systems during cycles of condensation, freezing, melting, and

  20. Incorporation of Medicinal Chemistry into the Organic Chemistry Curriculum

    ERIC Educational Resources Information Center

    Forbes, David C.

    2004-01-01

    Application of concepts presented in organic chemistry lecture using a virtual project involving the sythesis of medicinally important compounds is emphasized. The importance of reinforcing the concepts from lecture in lab, thus providing a powerful instructional means is discussed.

  1. Resident training in clinical chemistry.

    PubMed

    Genzen, Jonathan R; Krasowski, Matthew D

    2007-06-01

    Practicing clinical chemists responded to an anonymous, open-ended questionnaire designed to define the state of clinical chemistry education in pathology training programs in the United States. Survey respondents identified many ideas for educational improvements and offered criticism regarding aspects of clinical chemistry education that are not working particularly well. Many of these findings are generalizable to other subspecialties of clinical pathology. It is hoped that this analysis will allow readers to compare their programs with national trends and identify new ways of improving clinical chemistry training at their institutions. PMID:17556088

  2. Resident training in clinical chemistry.

    PubMed

    Genzen, Jonathan R; Krasowski, Matthew D

    2007-06-01

    Practicing clinical chemists responded to an anonymous, open-ended questionnaire designed to define the state of clinical chemistry education in pathology training programs in the United States. Survey respondents identified many ideas for educational improvements and offered criticism regarding aspects of clinical chemistry education that are not working particularly well. Many of these findings are generalizable to other subspecialties of clinical pathology. It is hoped that this analysis will allow readers to compare their programs with national trends and identify new ways of improving clinical chemistry training at their institutions.

  3. Cometary MHD and chemistry

    NASA Technical Reports Server (NTRS)

    Wegmann, R.; Schmidt, H. U.; Huebner, W. F.; Boice, D. C.

    1987-01-01

    An MHD and chemical comet-coma model was developed, applying the computer program of Huebner (1985) for the detailed chemical evolution of a spherically expanding coma and the program of Schmidt and Wegman (1982) and Wegman (1987) for the MHD flow of plasma and magnetic field in a comet to the Giotto-mission data on the ion abundances measured by the HIS ion mass spectrometer. The physics and chemistry of the coma are modeled in great detail, including photoprocesses, gas-phase chemical kinetics, energy balance with a separate electron temperature, multifluid hydrodynamics with a transition to free molecular flow, fast-streaming atomic and molecular hydrogen, counter and cross streaming of the ionized species relative to the neutral species in the coma-solar wind interaction region with momentum exchange by elastic collisions, mass-loading through ion pick-up, and Lorentz forces of the advected magnetic field. The results, both inside and outside of the contact surface, are discussed and compared with the relevant HIS ion mass spectra.

  4. Chemistry of ferroelectric surfaces.

    PubMed

    Garrity, K; Kolpak, A M; Ismail-Beigi, S; Altman, E I

    2010-07-20

    It has been recognized since the 1950s that the polar and switchable nature of ferroelectric surfaces can potentially lead to polarization direction-dependent surface chemistry. Recent theoretical studies and advances in growing high quality epitaxial ferroelectric thin films have motivated a flurry of experimental studies aimed at creating surfaces with switchable adsorption and catalytic properties, as well as films whose polarization direction switches depending on the gas phase environment. This research news article briefly reviews the key findings of these studies. These include observations that the adsorption strengths, and in certain cases the activation energies for reactions, of polar molecules on the surfaces of ferroelectric materials are sensitive to the polarization direction. For bare ferroelectric surfaces, the magnitudes of these differences are not large, but are still comparable to the energy barrier required to switch the polarization of approximately 10 nm thick films. Highlights of a recent study where chemical switching of a thin film ferroelectric was demonstrated are presented. Attempts to use the ferroelectric polarization to influence the behavior of supported catalytic metals will also be described. It will be shown that the tendency of the metals to cluster into particles makes it difficult to alter the chemical properties of the metal surface, since it is separated from the ferroelectric by several layers of metal atoms. An alternate approach to increasing the reactivity of ferroelectric surfaces is suggested that involves modifying the surface with atoms that bind strongly to the surface and thus remain atomically dispersed.

  5. Nuclear chemistry progress report

    SciTech Connect

    Viola, V.E.; Kwiatkowski, K.

    1993-08-01

    This is the annual progress report for the Indiana University nuclear chemistry program for the 1992/1993 year. Accomplishments include the construction, testing, and initial experimental runs of the Indiana Silicon Sphere (ISiS) 4{pi} charged particle detector. ISiS is designed to study energy dissipation and multifragmentation phenomena in light-ion-induced nuclear reactions at medium-to-high energies. Its second test run was to examine 3.6 GeV {sup 3}He beam reactions at Laboratoire National Saturne (LNS) in Saclay. The development and deployment of this system has occupied a great deal of the groups effort this reporting period. Additional work includes: calculations of isotopic IMF yields in the {sup 4}He + {sup 116,124}Sn reaction; cross sections for A = 6 - 30 fragments from the {sup 4}He + {sup 28}Si reaction at 117 and 198 MeV; charging effects of passivated silicon detectors; neck emission of intermediate-mass fragments in the fission of hot heavy nuclei.

  6. Organic chemistry on Titan

    NASA Technical Reports Server (NTRS)

    Chang, S.; Scattergood, T.; Aronowitz, S.; Flores, J.

    1978-01-01

    Observations of nonequilibrium phenomena on the Saturn satellite Titan indicate the occurrence of organic chemical evolution. Greenhouse and thermal inversion models of Titan's atmosphere provide environmental constraints within which various pathways for organic chemical synthesis are assessed. Experimental results and theoretical modeling studies suggest that the organic chemistry of the satellite may be dominated by two atmospheric processes: energetic-particle bombardment and photochemistry. Reactions initiated in various levels of the atmosphere by cosmic ray, Saturn wind, and solar wind particle bombardment of a CH4 - N2 atmospheric mixture can account for the C2-hydrocarbons, the UV-visible-absorbing stratospheric haze, and the reddish color of the satellite. Photochemical reactions of CH4 can also account for the presence of C2-hydrocarbons. In the lower Titan atmosphere, photochemical processes will be important if surface temperatures are sufficiently high for gaseous NH3 to exist. Hot H-atom reactions initiated by photo-dissociation of NH3 can couple the chemical reactions of NH3 and CH4 and produce organic matter.

  7. Marine fragrance chemistry.

    PubMed

    Hügel, Helmut M; Drevermann, Britta; Lingham, Anthony R; Marriott, Philip J

    2008-06-01

    The main marine message in perfumery is projected by Calone 1951 (7-methyl-2H-1,5-benzodioxepin-3(4H)-one). Kraft (Givaudan) and Gaudin (Firmenich) further maximized the marine fragrance molecular membership by extending the carbon chain of the 7-Me group. Our research targeted the polar group of the benzodioxepinone parent compound to investigate how this region of molecular makeup resonates with the dominant marine fragrance of the Calone 1951 structure. The olfactory evaluation of analogues prepared by chemical modification or removal of the CO group resulted in the introduction of aldehydic, sweet and floral-fruity notes with a diluted/diminished potency of the marine odor. To further analyze the olfactory properties of benzodioxepinones containing a diverse range of aromatic ring substituents, a novel synthesis route was developed. We found that a 7-alkyl group in Calone 1951 was essential for the maintenance of the significant marine odor characteristic, and our studies support the concept that the odorant structure occupying the hydrophobic binding pocket adjacent to the aromatic ring-binding site of the olfactory receptor is pivotal in the design and discovery of more potent and characteristic marine fragrances. How the structure of benzodioxepinones connects to marine sea-breeze fragrances is our continuing challenging research focus at the chemistry-biology interface.

  8. Chemistry in one dimension.

    PubMed

    Loos, Pierre-François; Ball, Caleb J; Gill, Peter M W

    2015-02-01

    We report benchmark results for one-dimensional (1D) atomic and molecular systems interacting via the Coulomb operator |x|(-1). Using various wavefunction-type approaches, such as Hartree-Fock theory, second- and third-order Møller-Plesset perturbation theory and explicitly correlated calculations, we study the ground state of atoms with up to ten electrons as well as small diatomic and triatomic molecules containing up to two electrons. A detailed analysis of the 1D helium-like ions is given and the expression of the high-density correlation energy is reported. We report the total energies, ionization energies, electron affinities and other physical properties of the many-electron 1D atoms and, using these results, we construct the 1D analog of Mendeleev's periodic table. We find that the 1D periodic table contains only two groups: the alkali metals and the noble gases. We also calculate the dissociation curves of several 1D diatomics and study the chemical bond in H2(+), HeH(2+), He2(3+), H2, HeH(+) and He2(2+). We find that, unlike their 3D counterparts, 1D molecules are primarily bound by one-electron bonds. Finally, we study the chemistry of H3(+) and we discuss the stability of the 1D polymer resulting from an infinite chain of hydrogen atoms. PMID:25518906

  9. Mars aqueous chemistry experiment

    NASA Technical Reports Server (NTRS)

    Clark, Benton C.; Mason, Larry W.

    1994-01-01

    Mars Aqueous Chemistry Experiment (MACE) is designed to conduct a variety of measurements on regolith samples, encompassing mineral phase analyses, chemical interactions with H2O, and physical properties determinations. From these data, much can be learned or inferred regarding the past weathering environment, the contemporaneous soil micro-environments, and the general chemical and physical state of the Martian regolith. By analyzing both soil and duricrust samples, the nature of the latter may become more apparent. Sites may be characterized for comparative purposes and criteria could be set for selection of high priority materials on future sample return missions. The second year of the MACE project has shown significant progress in two major areas. MACE Instrument concept definition is a baseline design that has been generated for the complete MACE instrument, including definition of analysis modes, mass estimates and thermal model. The design includes multiple reagent reservoirs, 10 discrete analysis cells, sample manipulation capability, and thermal control. The MACE Measurement subsystems development progress is reported regarding measurement capabilities for aqueous ion sensing, evolved gas sensing, solution conductivity measurement, reagent addition (titration) capabilities, and optical sensing of suspended particles.

  10. Computational Chemistry and Lubrication

    NASA Technical Reports Server (NTRS)

    Zehe, Michael J.

    1998-01-01

    Members of NASA Lewis Research Center's Tribology and Surface Science Branch are applying high-level computational chemistry techniques to the development of new lubrication systems for space applications and for future advanced aircraft engines. The next generation of gas turbine engines will require a liquid lubricant to function at temperatures in excess of 350 C in oxidizing environments. Conventional hydrocarbon-based lubricants are incapable of operating in these extreme environments, but a class of compounds known as the perfluoropolyether (PFAE) liquids (see the preceding illustration) shows promise for such applications. These commercially available products are already being used as lubricants in conditions where low vapor pressure and chemical stability are crucial, such as in satellite bearings and composite disk platters. At higher temperatures, however, these compounds undergo a decomposition process that is assisted (catalyzed) by metal and metal oxide bearing surfaces. This decomposition process severely limits the applicability of PFAE's at higher temperatures. A great deal of laboratory experimentation has revealed that the extent of fluid degradation depends on the chemical properties of the bearing surface materials. Lubrication engineers would like to understand the chemical breakdown mechanism to design a less vulnerable PFAE or to develop a chemical additive to block this degradation.

  11. Elimination chemistry in asphalt

    SciTech Connect

    Boucher, J.L.; Ihsiung Wang; Martinez, D.F. )

    1990-07-01

    Elimination chemistry provides important information, not only about the chemical properties of asphalt, but also the chemical modification method of asphalt. The chemical reactions which use the natural abundance of radicals are important for free-radical halogenation reaction. Spectral data demonstrates the formation of halogenated asphalt. The utility of dehydrohalogenation modified asphalt is limited. However, the resulting dehydrohalogenation modified asphalt does produce a significant unsaturated intermediate, which can incorporate elastomeric polymers (and monomers) via condensation or addition process. The second chemical modification method is the Hofmann elimination reaction, which was performed by reaction of methyl iodide with asphalt, followed by treatment of base. Spectroscopic data shows that a methyl group attached to nitrogen or sulfur in asphalt after Hofmann elimination reaction. Physical data shows that the Hofmann elimination modification improved the quality of asphalt, such as low temperature susceptibility measured by PVN. The modified asphalt also studied by HP-GPC in order to correlate their physical properties. The result shows that the molecular size distribution has changed and reduced the amount of LMS. The amount of decreasing LMS is also dependent on the content of nitrogen and sulfur in asphalts.

  12. The Dawn of Chemistry

    NASA Astrophysics Data System (ADS)

    Galli, Daniele; Palla, Francesco

    2013-08-01

    Within the precise cosmological framework provided by the Λ-cold dark matter model and standard Big Bang nucleosynthesis, the chemical evolution of the pregalactic gas can now be followed with accuracy limited only by the uncertainties on the reaction rates. Starting during the recombination era, the formation of the first molecules and molecular ions containing hydrogen, deuterium, helium, and lithium was severely hindered by the low density of the expanding Universe, the intensity of the cosmic radiation field, and the absence of solid catalyzers. Molecular hydrogen and deuterated hydrogen, the most abundant species formed in the gas phase prior to structure formation, played a fundamental role in the cooling of the gas clouds that gave birth to the first stellar generation, contributing to determine the scale of fragmentation. Primordial molecules also interacted with the photons of the cosmic background via resonant scattering, absorption, and emission. In this review, we examine the current status of the chemistry of the early Universe and discuss the most relevant reactions for which uncertainties still exist from theory or laboratory experiments. The prospects for detecting spectral distortions or spatial anisotropies due to the first atoms and molecules are also addressed.

  13. Advanced Chemistry Basins Model

    SciTech Connect

    Blanco, Mario; Cathles, Lawrence; Manhardt, Paul; Meulbroek, Peter; Tang, Yongchun

    2003-02-13

    The objective of this project is to: (1) Develop a database of additional and better maturity indicators for paleo-heat flow calibration; (2) Develop maturation models capable of predicting the chemical composition of hydrocarbons produced by a specific kerogen as a function of maturity, heating rate, etc.; assemble a compositional kinetic database of representative kerogens; (3) Develop a 4 phase equation of state-flash model that can define the physical properties (viscosity, density, etc.) of the products of kerogen maturation, and phase transitions that occur along secondary migration pathways; (4) Build a conventional basin model and incorporate new maturity indicators and data bases in a user-friendly way; (5) Develop an algorithm which combines the volume change and viscosities of the compositional maturation model to predict the chemistry of the hydrocarbons that will be expelled from the kerogen to the secondary migration pathways; (6) Develop an algorithm that predicts the flow of hydrocarbons along secondary migration pathways, accounts for mixing of miscible hydrocarbon components along the pathway, and calculates the phase fractionation that will occur as the hydrocarbons move upward down the geothermal and fluid pressure gradients in the basin; and (7) Integrate the above components into a functional model implemented on a PC or low cost workstation.

  14. Chemistry behind Vegetarianism.

    PubMed

    Li, Duo

    2011-02-01

    This review summarizes the effect of a habitual vegetarian diet on clinical complications in relation to chemistry and biochemistry. Omnivores have a significantly higher cluster of cardiovascular risk factors compared with vegetarians, including increased body mass index, waist to hip ratio, blood pressure, plasma total cholesterol (TC), triacylglycerol and LDL-C levels, serum lipoprotein(a) concentration, plasma factor VII activity, ratios of TC/HDL-C, LDL-C/HDL-C and TAG/HDL-C, and serum ferritin levels. Compared with omnivores, vegetarians, especially vegans, have lower serum vitamin B₁₂ concentration and n-3 polyunsaturated fatty acid (PUFA) levels in the tissue membrane phospholipids, which are associated with increased collagen and ADP stimulated ex vivo whole blood platelet aggregation, plasma 11-dehydrothromboxane B₂, and homocysteine levels and decreased plasma HDL-C. This may be associated with an increased thrombotic and atherosclerotic risk. It is suggested that vegetarians, especially vegans, should increase their dietary n-3 PUFA and vitamin B₁₂ intakes.

  15. Computational chemistry research

    NASA Technical Reports Server (NTRS)

    Levin, Eugene

    1987-01-01

    Task 41 is composed of two parts: (1) analysis and design studies related to the Numerical Aerodynamic Simulation (NAS) Extended Operating Configuration (EOC) and (2) computational chemistry. During the first half of 1987, Dr. Levin served as a member of an advanced system planning team to establish the requirements, goals, and principal technical characteristics of the NAS EOC. A paper entitled 'Scaling of Data Communications for an Advanced Supercomputer Network' is included. The high temperature transport properties (such as viscosity, thermal conductivity, etc.) of the major constituents of air (oxygen and nitrogen) were correctly determined. The results of prior ab initio computer solutions of the Schroedinger equation were combined with the best available experimental data to obtain complete interaction potentials for both neutral and ion-atom collision partners. These potentials were then used in a computer program to evaluate the collision cross-sections from which the transport properties could be determined. A paper entitled 'High Temperature Transport Properties of Air' is included.

  16. Chemistry in the Justice System.

    ERIC Educational Resources Information Center

    Hazdra, James J.

    1980-01-01

    The application of chemistry to the justice system is presented. The role of the forensic chemist, historical development of forensic laboratories, and tools of the criminalists are also discussed. (HM)

  17. Plants and Medicinal Chemistry--2

    ERIC Educational Resources Information Center

    Bailey, D.

    1977-01-01

    Second of a two part article on the influence of plants on medicinal chemistry. This part considers how drugs work, the attempts to develop anaesthetics safer than cocaine, and useful poisons. (Author/SL)

  18. Chemistry Education: Experiments Worth Running

    ERIC Educational Resources Information Center

    Kirchhoff, Mary M.

    2007-01-01

    The Education system has decided to introduce various new experiments and a digital system for imparting chemistry education to children in schools. The new programs are expected to prepare graduate students completely for their professional lives beyond the graduate school.

  19. Organic Experiments for Introductory Chemistry.

    ERIC Educational Resources Information Center

    Rayner-Canham, Geoff

    1985-01-01

    Describes test-tube organic chemistry procedures (using comparatively safe reagents) for the beginning student. These procedures are used to: examine differences between saturated and unsaturated hydrocarbons; compare structural isomers; and compare organic and inorganic acids and bases. (DH)

  20. Beginning Chemistry Can Be Relevant

    ERIC Educational Resources Information Center

    Corwin, James F.

    1971-01-01

    Reviews ways of applying laboratory work in general and analytical chemistry to supermarket products. Describes ways water and air pollution analysis can illustrate acid-base reactions, redox reactions, precipitimetry, and colorimetry. (PR)

  1. Chemistry for the Visually Impaired.

    ERIC Educational Resources Information Center

    Ratliff, Judy L.

    1997-01-01

    Discusses modifications to general education or introductory chemistry courses that allow visually impaired students to participate productively. Describes a strategy for teaching about elements and density, and the construction of a conductivity tester for visually impaired students. (JRH)

  2. Hot atom chemistry and radiopharmaceuticals

    SciTech Connect

    Krohn, Kenneth A.; Moerlein, Stephen M.; Link, Jeanne M.; Welch, Michael J.

    2012-12-19

    The chemical products made in a cyclotron target are a combined result of the chemical effects of the nuclear transformation that made the radioactive atom and the bulk radiolysis in the target. This review uses some well-known examples to understand how hot atom chemistry explains the primary products from a nuclear reaction and then how radiation chemistry is exploited to set up the optimal product for radiosynthesis. It also addresses the chemical effects of nuclear decay. There are important principles that are common to hot atom chemistry and radiopharmaceutical chemistry. Both emphasize short-lived radionuclides and manipulation of high specific activity nuclides. Furthermore, they both rely on radiochromatographic separation for identification of no-carrieradded products.

  3. Organometallic chemistry of metal surfaces

    SciTech Connect

    Muetterties, E.L.

    1981-06-01

    The organometallic chemistry of metal surfaces is defined as a function of surface crystallography and of surface composition for a set of cyclic hydrocarbons that include benzene, toluene, cyclohexadienes, cyclohexene, cyclohexane, cyclooctatetraene, cyclooctadienes, cyclooctadiene, cycloheptatriene and cyclobutane. 12 figures.

  4. [Pharmaceutical chemistry of general anaesthetics].

    PubMed

    Szász, György; Takácsné, Novák Krisztina

    2004-01-01

    The paper represents the first part of a planned series of reviews about pharmaceutical chemistry of drugs acting on the central nervous system. The authorial aim and editorial concepts are the same were followed in a former series of papers about pharmaceutical chemistry of agents effecting the heart, blood circulation and vegetative nervous system. Consequently, general anaesthetics are discussed in the present paper through the chapters "history, preparation; structure-properties-activity; application; analysis".

  5. Physical chemistry and the environment

    SciTech Connect

    Dunning, T.H. Jr.; Garrett, B.C.; Kolb, C.E. Jr.; Shaw, R.W.; Choppin, G.R.; Wagner, A.F.

    1994-08-01

    From the ozone hole and the greenhouse effect to plastics recycling and hazardous waste disposal, society faces a number of issues, the solutions to which require an unprecedented understanding of the properties of molecules. We are coming to realize that the environment is a coupled set of chemical systems, its dynamics determining the welfare of the biosphere and of humans in particular. These chemical systems are governed by fundamental molecular interactions, and they present chemists with an unparalleled challenge. The application of current concepts of molecular behavior and of up-to-date experimental and computational techniques can provide us with insights into the environment that are needed to mitigate past damage, to anticipate the impact of current human activity, and to avoid future insults to the environment. Environmental chemistry encompasses a number of separate, yet interlocking, areas of research. In all of these areas progress is limited by an inadequate understanding of the underlying chemical processes involved. Participation of all chemical approaches -- experimental, theoretical and computational -- and of all disciplines of chemistry -- organic, inorganic, physical, analytical and biochemistry -- will be required to provide the necessary fundamental understanding. The Symposium on ``Physical Chemistry and the Environment`` was designed to bring the many exciting and challenging physical chemistry problems involved in environmental chemistry to the attention of a larger segment of the physical chemistry community.

  6. Effective Chemistry Communication in Informal Environments

    ERIC Educational Resources Information Center

    National Academies Press, 2016

    2016-01-01

    Chemistry plays a critical role in daily life, impacting areas such as medicine and health, consumer products, energy production, the ecosystem, and many other areas. Communicating about chemistry in informal environments has the potential to raise public interest and understanding of chemistry around the world. However, the chemistry community…

  7. Peer Mentoring in the General Chemistry and Organic Chemistry Laboratories: The Pinacol Rearrangement--An Exercise in NMR and IR Spectroscopy for General Chemistry and Organic Chemistry Laboratories

    ERIC Educational Resources Information Center

    Arrington, Caleb A.; Hill, Jameica B.; Radfar, Ramin; Whisnant, David M.; Bass, Charles G.

    2008-01-01

    This article describes a discovery experiment for general chemistry and organic chemistry labs. Although the pinacol rearrangement has been employed in undergraduate organic laboratories before, in this application organic chemistry students act as mentors to students of general chemistry. Students work together using distillation--a new technique…

  8. The Place of Macromolecules in Freshman Chemistry

    ERIC Educational Resources Information Center

    Wunderlich, Bernhard

    1973-01-01

    Discusses the inclusion of knowledge on macromolecules into a freshman chemistry course which emphasizes topics in organic chemistry, polymer science and biochemistry, atoms, chemical thermodynamics, and inorganic chemistry. Indicates that the program is the only way to keep chemistry education up to date. (CC)

  9. Chemistry, College Level. Annotated Bibliography of Tests.

    ERIC Educational Resources Information Center

    Educational Testing Service, Princeton, NJ. Test Collection.

    Most of the 30 tests cited in this bibliography are those of the American Chemical Society. Subjects covered include physical chemistry, organic chemistry, inorganic chemistry, analytical chemistry, and other specialized areas. The tests are designed only for advanced high school, and both bachelor/graduate degree levels of college students. This…

  10. 42 CFR 493.839 - Condition: Chemistry.

    Code of Federal Regulations, 2011 CFR

    2011-10-01

    ... 42 Public Health 5 2011-10-01 2011-10-01 false Condition: Chemistry. 493.839 Section 493.839... These Tests § 493.839 Condition: Chemistry. The specialty of chemistry includes for the purposes of proficiency testing the subspecialties of routine chemistry, endocrinology, and toxicology....

  11. 42 CFR 493.839 - Condition: Chemistry.

    Code of Federal Regulations, 2012 CFR

    2012-10-01

    ... 42 Public Health 5 2012-10-01 2012-10-01 false Condition: Chemistry. 493.839 Section 493.839... These Tests § 493.839 Condition: Chemistry. The specialty of chemistry includes for the purposes of proficiency testing the subspecialties of routine chemistry, endocrinology, and toxicology....

  12. 42 CFR 493.839 - Condition: Chemistry.

    Code of Federal Regulations, 2013 CFR

    2013-10-01

    ... 42 Public Health 5 2013-10-01 2013-10-01 false Condition: Chemistry. 493.839 Section 493.839... These Tests § 493.839 Condition: Chemistry. The specialty of chemistry includes for the purposes of proficiency testing the subspecialties of routine chemistry, endocrinology, and toxicology....

  13. 42 CFR 493.839 - Condition: Chemistry.

    Code of Federal Regulations, 2010 CFR

    2010-10-01

    ... 42 Public Health 5 2010-10-01 2010-10-01 false Condition: Chemistry. 493.839 Section 493.839... These Tests § 493.839 Condition: Chemistry. The specialty of chemistry includes for the purposes of proficiency testing the subspecialties of routine chemistry, endocrinology, and toxicology....

  14. 42 CFR 493.839 - Condition: Chemistry.

    Code of Federal Regulations, 2014 CFR

    2014-10-01

    ... 42 Public Health 5 2014-10-01 2014-10-01 false Condition: Chemistry. 493.839 Section 493.839... These Tests § 493.839 Condition: Chemistry. The specialty of chemistry includes for the purposes of proficiency testing the subspecialties of routine chemistry, endocrinology, and toxicology....

  15. HOCO radical chemistry.

    PubMed

    Francisco, Joseph S; Muckerman, James T; Yu, Hua-Gen

    2010-12-21

    Free radicals are important species in atmospheric chemistry, combustion, plasma environments, interstellar clouds, and biochemistry. Therefore, researchers would like to understand the formation mechanism, structure, stability, reactivity, spectroscopy, and dynamics of these chemical species. However, due to the presence of one or more unpaired electrons, radicals are often very reactive and have short lifetimes, which makes it difficult to conduct experiments. The HOCO radical appears in the atmosphere as well as in combustion environments and plays an important role in the conversion of CO to CO(2). Through the interplay between theoretical and experimental investigations, researchers have only recently understood the chemical role of the HOCO radical. In this Account, we systematically describe the current state of knowledge of the HOCO radical based on recent theoretical and experimental studies. This radical's two stable conformers, trans- and cis-HOCO, have been identified by high-level ab initio calculations and experimental spectroscopy. trans-HOCO is more stable by approximately 1.8 kcal/mol. The heat of formation of HOCO (298 K) was determined to be -43.0 ± 0.5 kcal/mol, giving a potential well depth of 30.1 ± 0.5 kcal/mol relative to the asymptote of the reactants OH + CO. The HOCO radical is very reactive. In most reactions between the HOCO radical and atoms, the HOCO radical acts as a hydrogen donor to reaction partners. Generally, the hydrogen is transferred through the formation of an association intermediate, which then proceeds through a molecular elimination step to produce the reaction products. The reaction rates of HOCO with some small radicals fall in the range of 10(-11)-10(-10) cm(3) molecule(-1) s(-1). These results clearly illustrate important features in the reactivity of the HOCO radical with other molecules.

  16. Chemistry of fast electrons

    PubMed Central

    Maximoff, Sergey N.; Head-Gordon, Martin P.

    2009-01-01

    A chemicurrent is a flux of fast (kinetic energy ≳ 0.5−1.3 eV) metal electrons caused by moderately exothermic (1−3 eV) chemical reactions over high work function (4−6 eV) metal surfaces. In this report, the relation between chemicurrent and surface chemistry is elucidated with a combination of top-down phenomenology and bottom-up atomic-scale modeling. Examination of catalytic CO oxidation, an example which exhibits a chemicurrent, reveals 3 constituents of this relation: The localization of some conduction electrons to the surface via a reduction reaction, 0.5 O2 + δe− → Oδ− (Red); the delocalization of some surface electrons into a conduction band in an oxidation reaction, Oδ− + CO → CO2δ− → CO2 + δe− (Ox); and relaxation without charge transfer (Rel). Juxtaposition of Red, Ox, and Rel produces a daunting variety of metal electronic excitations, but only those that originate from CO2 reactive desorption are long-range and fast enough to dominate the chemicurrent. The chemicurrent yield depends on the universality class of the desorption process and the distribution of the desorption thresholds. This analysis implies a power-law relation with exponent 2.66 between the chemicurrent and the heat of adsorption, which is consistent with experimental findings for a range of systems. This picture also applies to other oxidation-reduction reactions over high work function metal surfaces. PMID:19561296

  17. National Chemistry Week 2000: JCE Resources in Food Chemistry

    NASA Astrophysics Data System (ADS)

    Jacobsen, Erica K.

    2000-10-01

    November brings another National Chemistry Week, and this year's theme is food chemistry. I was asked to collect and evaluate JCE resources for use with this theme, a project that took me deep into past issues of JCE and yielded many treasures. Here we present the results of searches for food chemistry information and activities. While the selected articles are mainly at the high school and college levels, there are some excellent ones for the elementary school level and some that can be adapted for younger students. The focus of all articles is on the chemistry of food itself. Activities that only use food to demonstrate a principle other than food chemistry are not included. Articles that cover household products such as cleansers and pharmaceuticals are also not included. Each article has been characterized as a demonstration, experiment, calculation, activity, or informational item; several fit more than one classification. Also included are keywords and an evaluation as to which levels the article may serve.

  18. Medicinal electrochemistry: integration of electrochemistry, medicinal chemistry and computational chemistry.

    PubMed

    Almeida, M O; Maltarollo, V G; de Toledo, R A; Shim, H; Santos, M C; Honorio, K M

    2014-01-01

    Over the last centuries, there were many important discoveries in medicine that were crucial for gaining a better understanding of several physiological processes. Molecular modelling techniques are powerful tools that have been successfully used to analyse and interface medicinal chemistry studies with electrochemical experimental results. This special combination can help to comprehend medicinal chemistry problems, such as predicting biological activity and understanding drug action mechanisms. Electrochemistry has provided better comprehension of biological reactions and, as a result of many technological improvements, the combination of electrochemical techniques and biosensors has become an appealing choice for pharmaceutical and biomedical analyses. Therefore, this review will briefly outline the present scope and future advances related to the integration of electrochemical and medicinal chemistry approaches based on various applications from recent studies. PMID:24533810

  19. Medicinal electrochemistry: integration of electrochemistry, medicinal chemistry and computational chemistry.

    PubMed

    Almeida, M O; Maltarollo, V G; de Toledo, R A; Shim, H; Santos, M C; Honorio, K M

    2014-01-01

    Over the last centuries, there were many important discoveries in medicine that were crucial for gaining a better understanding of several physiological processes. Molecular modelling techniques are powerful tools that have been successfully used to analyse and interface medicinal chemistry studies with electrochemical experimental results. This special combination can help to comprehend medicinal chemistry problems, such as predicting biological activity and understanding drug action mechanisms. Electrochemistry has provided better comprehension of biological reactions and, as a result of many technological improvements, the combination of electrochemical techniques and biosensors has become an appealing choice for pharmaceutical and biomedical analyses. Therefore, this review will briefly outline the present scope and future advances related to the integration of electrochemical and medicinal chemistry approaches based on various applications from recent studies.

  20. Cycloadditions in modern polymer chemistry.

    PubMed

    Delaittre, Guillaume; Guimard, Nathalie K; Barner-Kowollik, Christopher

    2015-05-19

    Synthetic polymer chemistry has undergone two major developments in the last two decades. About 20 years ago, reversible-deactivation radical polymerization processes started to give access to a wide range of polymeric architectures made from an almost infinite reservoir of functional building blocks. A few years later, the concept of click chemistry revolutionized the way polymer chemists approached synthetic routes. Among the few reactions that could qualify as click, the copper-catalyzed azide-alkyne cycloaddition (CuAAC) initially stood out. Soon, many old and new reactions, including cycloadditions, would further enrich the synthetic macromolecular chemistry toolbox. Whether click or not, cycloadditions are in any case powerful tools for designing polymeric materials in a modular fashion, with a high level of functionality and, sometimes, responsiveness. Here, we wish to describe cycloaddition methodologies that have been reported in the last 10 years in the context of macromolecular engineering, with a focus on those developed in our laboratories. The overarching structure of this Account is based on the three most commonly encountered cycloaddition subclasses in organic and macromolecular chemistry: 1,3-dipolar cycloadditions, (hetero-)Diels-Alder cycloadditions ((H)DAC), and [2+2] cycloadditions. Our goal is to briefly describe the relevant reaction conditions, the advantages and disadvantages, and the realized polymer applications. Furthermore, the orthogonality of most of these reactions is highlighted because it has proven highly beneficial for generating unique, multifunctional polymers in a one-pot reaction. The overview on 1,3-dipolar cycloadditions is mostly centered on the application of CuAAC as the most travelled route, by far. Besides illustrating the capacity of CuAAC to generate complex polymeric architectures, alternative 1,3-dipolar cycloadditions operating without the need for a catalyst are described. In the area of (H)DA cycloadditions

  1. Towards Bildung-Oriented Chemistry Education

    NASA Astrophysics Data System (ADS)

    Sjöström, Jesper

    2013-07-01

    This paper concerns Bildung-oriented chemistry education, based on a reflective and critical discourse of chemistry. It is contrasted with the dominant type of chemistry education, based on the mainstream discourse of chemistry. Bildung-oriented chemistry education includes not only content knowledge in chemistry, but also knowledge about chemistry, both about the nature of chemistry and about its role in society. In 2004 Mahaffy suggested a tetrahedron model based on Johnstone's chemical triangle. The latter represents the formal aspects of chemistry teaching (macro, submicro, and symbolic) and the top of the tetrahedron represents a human element. In the present paper the following subdivision of the top is suggested (starting from the bottom): (1) applied chemistry, (2) socio-cultural context, and (3) critical-philosophic approach. The professional identity of the Bildung-oriented chemistry teacher differs from that of the chemist and is informed by research fields such as Philosophy of Chemistry, Science and Technology Studies, and Environmental Education. He/she takes a socio-critical approach to chemistry, emphasising both the benefits and risks of chemistry and its applications.

  2. Atmospheric Chemistry and Air Pollution

    DOE PAGES

    Gaffney, Jeffrey S.; Marley, Nancy A.

    2003-01-01

    Atmospheric chemistry is an important discipline for understanding air pollution and its impacts. This mini-review gives a brief history of air pollution and presents an overview of some of the basic photochemistry involved in the production of ozone and other oxidants in the atmosphere. Urban air quality issues are reviewed with a specific focus on ozone and other oxidants, primary and secondary aerosols, alternative fuels, and the potential for chlorine releases to amplify oxidant chemistry in industrial areas. Regional air pollution issues such as acid rain, long-range transport of aerosols and visibility loss, and the connections of aerosols to ozonemore » and peroxyacetyl nitrate chemistry are examined. Finally, the potential impacts of air pollutants on the global-scale radiative balances of gases and aerosols are discussed briefly.« less

  3. Mass spectrometry. [in organic chemistry

    NASA Technical Reports Server (NTRS)

    Burlingame, A. L.; Shackleton, C. H. L.; Howe, I.; Chizhov, O. S.

    1978-01-01

    A review of mass spectrometry in organic chemistry is given, dealing with advances in instrumentation and computer techniques, selected topics in gas-phase ion chemistry, and applications in such fields as biomedicine, natural-product studies, and environmental pollution analysis. Innovative techniques and instrumentation are discussed, along with chromatographic-mass spectrometric on-line computer techniques, mass spectral interpretation and management techniques, and such topics in gas-phase ion chemistry as electron-impact ionization and decomposition, photoionization, field ionization and desorption, high-pressure mass spectrometry, ion cyclotron resonance, and isomerization reactions of organic ions. Applications of mass spectrometry are examined with respect to bio-oligomers and their constituents, biomedically important substances, microbiology, environmental organic analysis, and organic geochemistry.

  4. The Chemistry of Nearby Disks

    NASA Astrophysics Data System (ADS)

    Öberg, Karin I.

    2016-01-01

    The gas and dust rich disks around young stars are the formation sites of planets. Observations of molecular trace species have great potential as probes of the disk structures and volatile compositions that together regulate planet formation. The disk around young star TW Hya has become a template for disk molecular studies due to a combination of proximity, a simple face-on geometry and richness in volatiles. It is unclear, however, how typical the chemistry of the TW disk is. In this proceeding, we review lessons learnt from exploring the TW Hya disk chemistry, focusing on the CO snowline, and on deuterium fractionation chemistry. We compare these results with new ALMA observations toward more distant, younger disks. We find that while all disks have some chemical structures in common, there are also substantial differences between the disks, which may be due to different initial conditions, structural or chemical evolutionary stages, or a combination of all three.

  5. Surface chemistries for antibody microarrays

    SciTech Connect

    Seurynck-Servoss, Shannon L.; Baird, Cheryl L.; Rodland, Karin D.; Zangar, Richard C.

    2007-05-01

    Enzyme-linked immunosorbent assay (ELISA) microarrays promise to be a powerful tool for the detection of disease biomarkers. The original technology for printing ELISA microarray chips and capturing antibodies on slides was derived from the DNA microarray field. However, due to the need to maintain antibody structure and function when immobilized, surface chemistries used for DNA microarrays are not always appropriate for ELISA microarrays. In order to identify better surface chemistries for antibody capture, a number of commercial companies and academic research groups have developed new slide types that could improve antibody function in microarray applications. In this review we compare and contrast the commercially available slide chemistries, as well as highlight some promising recent advances in the field.

  6. Water Chemistry in Cometary Comae

    NASA Astrophysics Data System (ADS)

    Boice, D. C.

    2005-12-01

    Water chemistry is central in understanding the physics and chemistry of cometary comae. A rather advanced knowledge of water chemistry has been attained from studies of various comets via ground-based observations and in situ spacecraft measurements, especially the Giotto encounter with comet 1P/Halley. Photochemistry and the effects of photoelectrons that react via electron impact reactions, ion-molecule reactions, and the interaction with solar wind plasma are important processes that affect the overall composition and ionization state in the coma. However, initial results from the PEPE instrument onboard Deep Space 1 (DS1) concerning water-group ions around closest approach significantly differ from those expected from model results, challenging conventional notions. We have attempted to reconcile these differences in ion composition between the DS1 in situ measurements and model results with an extensive modeling investigation, unique from previous studies. This work should be relevant to past, on-going, and future spacecraft missions to comets.

  7. Atmospheric chemistry and air pollution.

    PubMed

    Gaffney, Jeffrey S; Marley, Nancy A

    2003-04-07

    Atmospheric chemistry is an important discipline for understanding air pollution and its impacts. This mini-review gives a brief history of air pollution and presents an overview of some of the basic photochemistry involved in the production of ozone and other oxidants in the atmosphere. Urban air quality issues are reviewed with a specific focus on ozone and other oxidants, primary and secondary aerosols, alternative fuels, and the potential for chlorine releases to amplify oxidant chemistry in industrial areas. Regional air pollution issues such as acid rain, long-range transport of aerosols and visibility loss, and the connections of aerosols to ozone and peroxyacetyl nitrate chemistry are examined. Finally, the potential impacts of air pollutants on the global-scale radiative balances of gases and aerosols are discussed briefly.

  8. Molten fluoride fuel salt chemistry

    NASA Astrophysics Data System (ADS)

    Toth, L. M.; Del Cul, G. D.; Dai, S.; Metcalf, D. H.

    1995-01-01

    The chemistry of molten fluorides is traced from their development as fuels in the Molten Salt Reactor Experiment with important factors in their selection being discussed. Key chemical characteristics such as solubility, redox behavior, and chemical activity are explained as they relate to the behavior of molten fluoride fuel systems. Development requirements for fitting the current state of the chemistry to modern nuclear fuel system are described. It is concluded that while much is known about molten fluoride behavior which can be used effectively to reduce the amount of development required for future systems, some significant molten salt chemical questions must still be addressed.

  9. Molten fluoride fuel salt chemistry

    NASA Astrophysics Data System (ADS)

    Toth, L. M.; Delcul, G. D.; Dai, S.; Metcalf, D. H.

    The chemistry of molten fluorides is traced from their development as fuels in the Molten Salt Reactor Experiment with important factors in their selection being discussed. Key chemical characteristics such as solubility, redox behavior, and chemical activity are explained as they relate to the behavior of molten fluoride fuel systems. Development requirements for fitting the current state of the chemistry to modern nuclear fuel system are described. It is concluded that while much is known about molten fluoride behavior which can be used effectively to reduce the amount of development required for future systems, some significant molten salt chemical questions must still be addressed.

  10. Molten fluoride fuel salt chemistry

    NASA Astrophysics Data System (ADS)

    Toth, L. M.; Del Cul, G. D.; Dai, S.; Metcalf, D. H.

    1995-09-01

    The chemistry of molten fluorides is traced from their development as fuels in the Molten Salt Reactor Experiment with important factors in their selection being discussed. Key chemical characteristics such as solubility, redox behavior, and chemical activity are explained as they relate to the behavior of molten fluoride fuel systems. Fission product behavior is described along with processing experience. Development requirements for fitting the current state of the chemistry to modern nuclear fuel system are described. It is concluded that while much is known about molten fluoride behavior, processing and recycle of the fuel components is a necessary factor if future systems are to be established.

  11. A Wet Chemistry Laboratory Cell

    NASA Technical Reports Server (NTRS)

    2008-01-01

    This picture of NASA's Phoenix Mars Lander's Wet Chemistry Laboratory (WCL) cell is labeled with components responsible for mixing Martian soil with water from Earth, adding chemicals and measuring the solution chemistry. WCL is part of the Microscopy, Electrochemistry, and Conductivity Analyzer (MECA) instrument suite on board the Phoenix lander.

    The Phoenix Mission is led by the University of Arizona, Tucson, on behalf of NASA. Project management of the mission is by NASA's Jet Propulsion Laboratory, Pasadena, Calif. Spacecraft development is by Lockheed Martin Space Systems, Denver.

  12. Molten fluoride fuel salt chemistry

    SciTech Connect

    Toth, L.M.; Del Cul, G.D.; Dai, S.; Metcalf, D.H.

    1994-09-01

    The chemistry of molten fluorides is traced from their development as fuels in the Molten Salt Reactor Experiment with important factors in their selection being discussed. Key chemical characteristics such as solubility, redox behavior, and chemical activity are explained as they relate to the behavior of molten fluoride fuel systems. Fission product behavior is described along with processing experience. Development requirements for fitting the current state of the chemistry to modern nuclear fuel system are described. It is concluded that while much is known about molten fluoride behavior, processing and recycle of the fuel components is a necessary factor if future systems are to be established.

  13. NMR methods in combinatorial chemistry.

    PubMed

    Shapiro, M J; Wareing, J R

    1998-06-01

    The use of NMR spectroscopy in combinatorial chemistry has provided a versatile tool for monitoring combinatorial chemistry reactions and for assessing ligand-receptor interactions. The application of magic angle spinning NMR is widespread and has allowed structure determination to be performed on compounds attached to solid supports. A variety of two-dimensional NMR techniques have been applied to enhance the usability of the magic angle spinning NMR data. New developments for solution NMR analysis include high performance liquid chromatography, NMR, mass spectroscopy and flow NMR. NMR based methods currently being investigated may prove valuable as compound screening tools.

  14. Sustainable Chemistry at Sungkyunkwan University.

    PubMed

    Park, Nam-Gyu

    2015-07-20

    Special Issue: Sustainable Chemistry at Sungkyunkwan University. Sustainable chemistry is key to the development of efficient renewable energies, which will become more and more important in order to combat global warming. In this Editorial, guest editor Prof. Nam-Gyu Park describes the context of this Special Issue on top-quality research towards sustainability performed at Sungkyunkwan University (SKKU) in Korea. Scientists at SKKU work on, for example, photovoltaic solar cells to generate low-cost electricity, lithium batteries and capacitors to store electricity, piezoelectric nanogenerators, thermoelectric devices, hydrogen generation, and fuel cells.

  15. Perspectives on Computational Organic Chemistry

    PubMed Central

    Streitwieser, Andrew

    2009-01-01

    The author reviews how his early love for theoretical organic chemistry led to experimental research and the extended search for quantitative correlations between experiment and quantum calculations. The experimental work led to ion pair acidities of alkali-organic compounds and most recently to equilibria and reactions of lithium and cesium enolates in THF. This chemistry is now being modeled by ab initio calculations. An important consideration is the treatment of solvation in which coordination of the alkali cation with the ether solvent plays a major role. PMID:19518150

  16. Fuel cell chemistry and operation

    NASA Astrophysics Data System (ADS)

    Hamrock, Steven J.; Herring, Andrew M.; Zawodzinski, Thomas A.

    The annual fall symposium on Fuel Cell Chemistry and Operation was held at the 232nd National Meeting of the American Chemical Society in San Francisco, CA on September 11-14, 2006. Similar symposia sponsored by the Fuel Division have been held every fall since 1999. Significantly, this symposium was part of an ACS Presidential Event on Hydrogen, and was sponsored by a number of other ACS divisions including, Polymer, Polymeric Materials: Science and Engineering, Petroleum, Industrial and Engineering Chemistry, and the Inorganic divisions. Additional support was provided by the Petroleum Research Fund and the 3M Fuel Cell Components Group.

  17. Sustainable Chemistry at Sungkyunkwan University.

    PubMed

    Park, Nam-Gyu

    2015-07-20

    Special Issue: Sustainable Chemistry at Sungkyunkwan University. Sustainable chemistry is key to the development of efficient renewable energies, which will become more and more important in order to combat global warming. In this Editorial, guest editor Prof. Nam-Gyu Park describes the context of this Special Issue on top-quality research towards sustainability performed at Sungkyunkwan University (SKKU) in Korea. Scientists at SKKU work on, for example, photovoltaic solar cells to generate low-cost electricity, lithium batteries and capacitors to store electricity, piezoelectric nanogenerators, thermoelectric devices, hydrogen generation, and fuel cells. PMID:26183687

  18. Doing Chemistry: A Resource for High School Chemistry Teachers.

    ERIC Educational Resources Information Center

    Journal of Chemical Education, 1989

    1989-01-01

    Described is a practical resource that ties the specifics of classroom chemistry content to the specifics of teaching practice. Listed are 135 lessons found on three videodisks which have 700 pages of supporting written materials. Notes that the full gamut of the traditional high school curriculum is covered. (MVL)

  19. Integrating Computational Chemistry into the Physical Chemistry Curriculum

    ERIC Educational Resources Information Center

    Johnson, Lewis E.; Engel, Thomas

    2011-01-01

    Relatively few undergraduate physical chemistry programs integrate molecular modeling into their quantum mechanics curriculum owing to concerns about limited access to computational facilities, the cost of software, and concerns about increasing the course material. However, modeling exercises can be integrated into an undergraduate course at a…

  20. Chemistry on the Go: Review of Chemistry Apps on Smartphones

    ERIC Educational Resources Information Center

    Libman, Diana; Huang, Ling

    2013-01-01

    touch-controlled computers such as smartphones and iPods are seeing dramatic growth with increasing adoption rates. This review covers about 30 popular and mostly free apps that can be used to learn chemistry and to serve as reference or research tools. The target…

  1. Integrating Particulate Representations into AP Chemistry and Introductory Chemistry Courses

    ERIC Educational Resources Information Center

    Prilliman, Stephen G.

    2014-01-01

    The College Board's recently revised curriculum for advanced placement (AP) chemistry places a strong emphasis on conceptual understanding, including representations of particle phenomena. This change in emphasis is informed by years of research showing that students could perform algorithmic calculations but not explain those calculations…

  2. Comparing Carbonyl Chemistry in Comprehensive Introductory Organic Chemistry Textbooks

    ERIC Educational Resources Information Center

    Nelson, Donna J.; Kumar, Ravi; Ramasamy, Saravanan

    2015-01-01

    Learning the chemistry of compounds containing carbonyl groups is difficult for undergraduate students partly because of a convolution of multiple possible reaction sites, competitive reactions taking place at those sites, different criteria needed to discern between the mechanisms of these reactions, and no straightforward selection method…

  3. General Chemistry Students' Goals for Chemistry Laboratory Coursework

    ERIC Educational Resources Information Center

    DeKorver, Brittland K.; Towns, Marcy H.

    2015-01-01

    Little research exists on college students' learning goals in chemistry, let alone specifically pertaining to laboratory coursework. Because students' learning goals are linked to achievement and dependent on context, research on students' goals in the laboratory context may lead to better understanding about the efficacy of lab curricula. This…

  4. 1997 Atmospheric Chemistry Colloquium for Emerging Senior Scientists

    SciTech Connect

    Paul H. Wine

    1998-11-23

    DOE's Atmospheric Chemistry Program is providing partial funding for the Atmospheric Chemistry Colloquium for Emerging Senior Scientists (ACCESS) and FY 1997 Gordon Research Conference in Atmospheric Chemistry

  5. Developing an online chemistry laboratory for non-chemistry majors

    NASA Astrophysics Data System (ADS)

    Poole, Jacqueline H.

    Distance education, also known as online learning, is student-centered/self-directed educational opportunities. This style of learning is expanding in scope and is increasingly being accepted throughout the academic curriculum as a result of its flexibility for the student as well as the cost-effectiveness for the institution. Nevertheless, the introduction of online science courses including chemistry and physics have lagged behind due to the challenge of re-creation of the hands-on laboratory learning experience. This dissertation looks at the effectiveness of the design of a series of chemistry laboratory experiments for possible online delivery that provide students with simulated hands-on experiences. One class of college Chemistry 101 students conducted chemistry experiments inside and outside of the physical laboratory using instructions on Blackboard and Late Nite Labs(TM). Learning outcomes measured by (a) pretests, (b) written laboratory reports, (c) posttest assessments, (d) student reactions as determined by a questionnaire, and (e) a focus group interview were utilized to compare both types of laboratory experiences. The research findings indicated learning outcomes achieved by students outside of the traditional physical laboratory were statistically greater than the equivalent face-to-face instruction in the traditional laboratory. Evidence from student reactions comparing both types of laboratory formats (online and traditional face-to-face) indicated student preference for the online laboratory format. The results are an initial contribution to the design of a complete sequence of experiments that can be performed independently by online students outside of the traditional face-to-face laboratory that will satisfy the laboratory requirement for the two-semester college Chemistry 101 laboratory course.

  6. Green chemistry for chemical synthesis.

    PubMed

    Li, Chao-Jun; Trost, Barry M

    2008-09-01

    Green chemistry for chemical synthesis addresses our future challenges in working with chemical processes and products by inventing novel reactions that can maximize the desired products and minimize by-products, designing new synthetic schemes and apparati that can simplify operations in chemical productions, and seeking greener solvents that are inherently environmentally and ecologically benign. PMID:18768813

  7. Teaching Triple Science: GCSE Chemistry

    ERIC Educational Resources Information Center

    Learning and Skills Network (NJ3), 2007

    2007-01-01

    The Department for Children, Schools and Families (DCSF) has contracted with the Learning and Skills Network to support awareness and take-up of Triple Science GCSEs through the Triple Science Support Programme. This publication provides an introduction to teaching and learning approaches for the extension topics within GCSE Chemistry. It…

  8. Visualizing Chemistry: Investigations for Teachers.

    ERIC Educational Resources Information Center

    Ealy, Julie B.; Ealy, James L., Jr.

    This book contains 101 investigations for chemistry classrooms. Topics include: (1) Physical Properties; (2) Reactions of Some Elements; (3) Reactions Involving Gases; (4) Energy Changes; (5) Solutions and Solubility; (6) Transition Metals and Complex Ions; (7) Kinetics and Equilibrium; (8) Acids and Bases; (9) Oxidation-Reduction; (10)…

  9. Astronomy Matters for Chemistry Teachers.

    ERIC Educational Resources Information Center

    Huebner, Jay S.; And Others

    1996-01-01

    Describes basic misconceptions about the origin of elements and forms of matter found in chemistry texts that need modification in light of modern observational data and interpretations given in astronomy. Notes that there are forms of matter other than elements and compounds. Confounding examples from astronomy include white dwarfs, neutron…

  10. Organic chemistry in Titan's atmosphere

    NASA Technical Reports Server (NTRS)

    Scattergood, T.

    1982-01-01

    Laboratory photochemical simulations and other types of chemical simulations are discussed. The chemistry of methane, which is the major known constituent of Titan's atmosphere was examined with stress on what can be learned from photochemistry and particle irradiation. The composition of dust that comprises the haze layer was determined. Isotope fractionation in planetary atmospheres is also discussed.

  11. Plasma chemistry and organic synthesis

    NASA Technical Reports Server (NTRS)

    Tezuka, M.

    1980-01-01

    The characteristic features of chemical reactions using low temperature plasmas are described and differentiated from those seen in other reaction systems. A number of examples of applications of plasma chemistry to synthetic reactions are mentioned. The production of amino acids by discharge reactions in hydrocarbon-ammonia-water systems is discussed, and its implications for the origins of life are mentioned.

  12. Chemistry Teaching: Science or Alchemy?

    ERIC Educational Resources Information Center

    Johnstone, A. H.

    1997-01-01

    Suggests that the development of good chemistry teaching and the pursuit of research have essentially the same structure. Similarities include the need for a clear focus, efficiency in time and effort, and a direction that is more often right than wrong. (DDR)

  13. Chemistry without borders: An overview

    Technology Transfer Automated Retrieval System (TEKTRAN)

    As chemistry becomes more globalized, it is important for an organization to be interconnected and adaptable, and for an individual to keep up with changes and latest scientific findings and keep options open. Many of the challenges and the opportunities of globalization are in the areas of jobs, re...

  14. Chemistry--The Big Picture

    ERIC Educational Resources Information Center

    Cassell, Anne

    2011-01-01

    Chemistry produces materials and releases energy by ionic or electronic rearrangements. Three structure types affect the ease with which a reaction occurs. In the Earth's crust, "solid crystals" change chemically only with extreme heat and pressure, unless their fixed ions touch moving fluids. On the other hand, in living things, "liquid crystals"…

  15. The Chemistry of Color Photography

    ERIC Educational Resources Information Center

    Guida, Wayne C.; Raber, Douglas J.

    1975-01-01

    Presents several topics in color photography which can serve as an introduction of scientific concepts into the classroom, such as: photochemistry (energy transport), organic chemistry (dye formation), physics (nature of light), psychology (color perception), and engineering (isolation of different chemical processes within layers of the film).…

  16. Instructor's Guide for General Chemistry.

    ERIC Educational Resources Information Center

    Schlenker, Richard M.

    The first part of this curriculum guide for a college-level general chemistry course includes: (1) a list of 28 lectures/lessons with topic titles and content divisions; (2) behavioral objectives related to specific lessons; (3) a list of laboratory activities and objectives; (4) a course overview and syllabus for spring semester 1981; and (5) a…

  17. Atmospheric chemistry over southern Africa

    NASA Astrophysics Data System (ADS)

    Gatebe, Charles K.; Levy, Robert C.; Thompson, Anne M.

    2012-03-01

    Changing Chemistry in a Changing Climate: Human and Natural Impacts Over Southern Africa (C4-SAR); Midrand, South Africa, 31 May to 3 June 2011 During the southern African dry season, regional haze from mixed industrial pollution, biomass burning aerosol and gases from domestic and grassland fires, and biogenic sources from plants and soils is worsened by a semipermanent atmospheric gyre over the subcontinent. These factors were a driver of several major international field campaigns in the 1990s and early 2000s and attracted many scientists to the region. Some researchers were interested in understanding fundamental processes governing chemistry of the atmosphere and interaction with climate change. Others found favorable conditions for evaluating satellite- derived measurements of atmospheric properties and a changing land surface. With that background in mind a workshop on atmospheric chemistry was held in South Africa. Sponsored by the International Commission on Atmospheric Chemistry and Global Pollution (ICACGP; http://www.icacgp.org/), the workshop received generous support from Eskom, the South African power utility; and the Climatology Research Group of the University of the Witwatersrand, Johannesburg, South Africa.

  18. General Chemistry for Waste Handlers.

    ERIC Educational Resources Information Center

    Sixtus, Michael E.

    This manual is intended for use in presenting a course which provides the content-specific general chemistry education required for the safety awareness and job enhancement of persons employed as waste handlers. The course, which was designed to be delivered to technicians at job sites in a lecture/demonstration format with several hands-on…

  19. Chemistry Perfumes Your Daily Life

    ERIC Educational Resources Information Center

    Fortineau, Anne-Dominique

    2004-01-01

    A synopsis on the history of perfumery is presented, along with the various processes accessible for obtaining natural perfume constituents, and creation of synthetic chemicals. The important contribution of organic chemists in the invention of perfumes, aspects of fragrance chemistry, and general information on the perfume industry are…

  20. A Comprehensive General Chemistry Demonstration

    ERIC Educational Resources Information Center

    Sweeder, Ryan D.; Jeffery, Kathleen A.

    2013-01-01

    This article describes the use of a comprehensive demonstration suitable for a high school or first-year undergraduate introductory chemistry class. The demonstration involves placing a burning candle in a container adjacent to a beaker containing a basic solution with indicator. After adding a lid, the candle will extinguish and the produced…

  1. Radiation Chemistry in Organized Assemblies.

    ERIC Educational Resources Information Center

    Thomas, J. K.; Chen, T. S.

    1981-01-01

    Expands the basic concepts regarding the radiation chemistry of simple aqueous systems to more complex, but well defined, organized assemblies. Discusses the differences in behavior in comparison to simple systems. Reviews these techniques: pulse radiolysis, laser flash, photolysis, and steady state irradiation by gamma rays or light. (CS)

  2. Green Chemistry with Microwave Energy

    EPA Science Inventory

    Green chemistry utilizes a set of 12 principles that reduces or eliminates the use or generation of hazardous substances in the design, manufacture, and applications of chemical products (1). This newer chemical approach protects the environment by inventing safer and eco-friendl...

  3. Green chemistry for chemical synthesis

    PubMed Central

    Li, Chao-Jun; Trost, Barry M.

    2008-01-01

    Green chemistry for chemical synthesis addresses our future challenges in working with chemical processes and products by inventing novel reactions that can maximize the desired products and minimize by-products, designing new synthetic schemes and apparati that can simplify operations in chemical productions, and seeking greener solvents that are inherently environmentally and ecologically benign. PMID:18768813

  4. News from Online: Kitchen Chemistry

    NASA Astrophysics Data System (ADS)

    Sweeney Judd, Carolyn

    2000-10-01

    And one of the best sources for kitchen activities is the JCE Classroom Activities from the Journal of Chemical Education, edited by Nancy S. Gettys and Erica K. Jacobsen. Go to Anthocyanins: A Colorful Class of Compounds for acid-base indicators made from another item in the kitchen, purple cabbage--my favorite kitchen chemistry experiment.

  5. Text Editing in Chemistry Instruction.

    ERIC Educational Resources Information Center

    Ngu, Bing Hiong; Low, Renae; Sweller, John

    2002-01-01

    Describes experiments with Australian high school students that investigated differences in performance on chemistry word problems between two learning strategies: text editing, and conventional problem solving. Concluded that text editing had no advantage over problem solving in stoichiometry problems, and that the suitability of a text editing…

  6. Thirty years through vanadium chemistry.

    PubMed

    Costa Pessoa, J

    2015-06-01

    The relevance of vanadium in biological systems is known for many years and vanadium-based catalysts have important industrial applications, however, till the beginning of the 80s research on vanadium chemistry and biochemistry did not receive much attention from the scientific community. The understanding of the broad bioinorganic implications resulting from the similarities between phosphate and vanadate(V) and the discovery of vanadium dependent enzymes gave rise to an enormous increase in interest in the chemistry and biological relevance of vanadium. Thereupon the last 30years corresponded to a period of enormous research effort in these fields, as well as in medicinal applications of vanadium and in the development of catalysts for use in fine-chemical synthesis, some of these inspired by enzymatic active sites. Since the 80s my group in collaboration with others made contributions, described throughout this text, namely in the understanding of the speciation of vanadium compounds in aqueous solution and in biological fluids, and to the transport of vanadium compounds in blood plasma and their uptake by cells. Several new types of vanadium compounds were also synthesized and characterized, with applications either as prospective therapeutic drugs or as homogeneous or heterogenized catalysts for the production of fine chemicals. The developments made are described also considering the international context of the evolution of the knowledge in the chemistry and bioinorganic chemistry of vanadium compounds during the last 30years. This article was compiled based on the Vanadis Award presentation at the 9th International Vanadium Symposium.

  7. Botany, Chemistry, and Tropical Development.

    ERIC Educational Resources Information Center

    Headrick, Daniel R.

    1996-01-01

    Examines the role played by botany and chemistry in the development, exploitation, and later deterioration of tropical economies. Although near equals in 19th-century international trade, the development of synthetics by European scientists in the early 20th century crippled the tropical economies. Research, innovation, and investment protected…

  8. Ullmann's Encyclopedia of Industrial Chemistry.

    ERIC Educational Resources Information Center

    Chadwick, Sharon S.

    1988-01-01

    This review compares "Ullmann's Encyclopedia of Industrial Chemistry" with the "Kirk-Othmer Encyclopedia of Chemical Technology," two prominent encyclopedias of chemical technology and industry. Cost, quantity of information, organization, illustrations, authorship, abbreviations, online availability, and content of articles are discussed. (MES)

  9. Chromium Chemistry in the Subsurface

    EPA Science Inventory

    Chromium (VI) (Cr) is carcinogenic and a threat to human and ecological health. There are adequate and acceptable methods to characterize and assess Cr contaminated sites. Cr chemistry in the environment is well understood. There are documented methods to address Cr contaminat...

  10. Computational Chemistry of Adhesive Bonds

    NASA Technical Reports Server (NTRS)

    Phillips, Donald H.

    1999-01-01

    This investigation is intended to determine the electrical mechanical, and chemical properties of adhesive bonds at the molecular level. The initial determinations will be followed by investigations of the effects of environmental effects on the chemistry and properties of the bond layer.

  11. Microcomputer Applications in Analytical Chemistry.

    ERIC Educational Resources Information Center

    Long, Joseph W.

    The first part of this paper addresses the following topics: (1) the usefulness of microcomputers; (2) applications for microcomputers in analytical chemistry; (3) costs; (4) major microcomputer systems and subsystems; and (5) which microcomputer to buy. Following these brief comments, the major focus of the paper is devoted to a discussion of…

  12. Dreyfus/Wilson Chemistry Institute.

    ERIC Educational Resources Information Center

    Tanis, Dave

    1982-01-01

    Describes a four-week summer science program for high school chemistry teachers. The program was divided into four segments and focused on "Electrons in Motion." Specific areas addressed included instructional methodology, electron transfer processes, electrons and kinetics/chemical reactions, and background information on the tetrahederal atom…

  13. Chemistry Curriculum Guide. Bulletin 1660.

    ERIC Educational Resources Information Center

    Louisiana State Dept. of Education, Baton Rouge. Div. of Academic Programs.

    This curriculum guide, developed to establish statewide curriculum standards for the Louisiana Competency-based Education Program, contains the minimum competencies and process skills that should be included in a chemistry course. It consists of: (1) a rationale for an effective science program; (2) a list and description of four major goals of…

  14. Analytical Chemistry and the Microchip.

    ERIC Educational Resources Information Center

    Lowry, Robert K.

    1986-01-01

    Analytical techniques used at various points in making microchips are described. They include: Fourier transform infrared spectrometry (silicon purity); optical emission spectroscopy (quantitative thin-film composition); X-ray photoelectron spectroscopy (chemical changes in thin films); wet chemistry, instrumental analysis (process chemicals);…

  15. Teaching Techniques in Clinical Chemistry.

    ERIC Educational Resources Information Center

    Wilson, Diane

    This master's thesis presents several instructional methods and techniques developed for each of eleven topics or subject areas in clinical chemistry: carbohydrate metabolism, lipid metabolism, diagnostic enzymology, endocrinology, toxicology, quality control, electrolytes, acid base balance, hepatic function, nonprotein nitrogenous compounds, and…

  16. Synthesis: Click chemistry gets reversible

    NASA Astrophysics Data System (ADS)

    Fulton, David A.

    2016-10-01

    'Click' chemistry allows for the linking together of chemical modules, however, there are currently no methods that also allow for facile 'declicking' to unlink them. Now, a method has been developed to click together amines and thiols, and then allow a chemically triggered declick reaction to release the original molecular components.

  17. Organometallic chemistry: A new metathesis

    NASA Astrophysics Data System (ADS)

    Hennessy, Elisabeth T.; Jacobsen, Eric N.

    2016-08-01

    Carbonyls and alkenes, two of the most common functional groups in organic chemistry, generally do not react with one another. Now, a simple Lewis acid has been shown to catalyse metathesis between alkenes and ketones in a new carbonyl olefination reaction.

  18. The Chemistry of the Planets.

    ERIC Educational Resources Information Center

    Blake, Peter

    1988-01-01

    Introduces knowledge of planetary chemistry for possible use in teaching. Discusses the chemical composition of the planets; the atmosphere and clouds of Venus, Jupiter and its moons, and Titan. Includes diagrams of the greenhouse effects in the solar system, elemental abundances, and the chemical composition of Jupiter. (RT)

  19. Argumentation in Undergraduate Chemistry Laboratories

    ERIC Educational Resources Information Center

    Walker, Joi Phelps

    2011-01-01

    To address the need for reform in undergraduate science education a new instructional model called "Argument-Driven Inquiry" (ADI) was developed and then implemented in a undergraduate chemistry course at a community college in the southeastern United States (Sampson, Walker, & Grooms, 2009; Walker, Sampson, & Zimmerman, in press). The ADI…

  20. The Chemistry of Optical Discs.

    ERIC Educational Resources Information Center

    Birkett, David

    2002-01-01

    Explains the chemistry used in compact discs (CD), digital versatile discs (DVD), and magneto-optical (MO) discs focusing on the steps of initial creation of the mold, the molding of the polycarbonate, the deposition of the reflective layers, the lacquering of the CDs, and the bonding of DVDs. (Contains 15 references.) (YDS)

  1. An Introduction to Air Chemistry.

    ERIC Educational Resources Information Center

    Butcher, Samuel S.; Charlson, Robert J.

    Designed for those with no previous experience in the field, this book synthesizes the areas of chemistry and meteorology required to bring into focus some of the complex problems associated with the atmospheric environment. Subject matter moves from a review of the relevant chemical and meteorological principles to a discussion of the general…

  2. Neglect of Solid State Chemistry Scored

    ERIC Educational Resources Information Center

    Chemical and Engineering News, 1974

    1974-01-01

    At a recent symposium concerning the teaching of solid state chemistry in the classroom, many educators indicated that important areas of solid state chemistry were being neglected in college curricula. (RH)

  3. Environmental Chemistry in the High School Curriculum.

    ERIC Educational Resources Information Center

    Stearns, Carole

    1988-01-01

    Discusses the incorporation of environmental chemistry topics into the traditional high school chemistry curriculum. Describes and provides lesson plans for the sulfur cycle and acid rain, and radioactivity and nuclear energy. Considers possible laboratory experiments. (CW)

  4. Some Exercises Reflecting Green Chemistry Concepts

    ERIC Educational Resources Information Center

    Song, Yu-Min; Wang, Yong-Cheng; Geng, Zhi-Yuan

    2004-01-01

    Some exercises to introduce students to the concept of green chemistry are given. By doing these exercises, students develop an appreciation for the role of green chemistry on feedstock substitution, milder reaction conditions, reduced environmental exposure, and resource conservation.

  5. Outlook Bright for Computers in Chemistry.

    ERIC Educational Resources Information Center

    Baum, Rudy M.

    1981-01-01

    Discusses the recent decision to close down the National Resource for Computation in Chemistry (NRCC), implications of that decision, and various alternatives in the field of computational chemistry. (CS)

  6. EVALUATING THE SUSTAINABILITY OF GREEN CHEMISTRIES

    EPA Science Inventory

    The U.S. EPA's National Risk Management Research Laboratory is developing a methodology for the evaluation of reaction chemistries. This methodology, called GREENSCOPE (Gauging Reaction Effectiveness for the ENvironmental Sustainability of Chemistries with a multi-Objective Proc...

  7. Chemistry for Artists and Art Buffs.

    ERIC Educational Resources Information Center

    Denio, Allen A.

    1979-01-01

    This course provides an attractive introduction to chemistry for a group of students who would normally avoid traditional chemistry courses. Topics include color, pigments, metals, ceramics, glass, paints, plastics, fibers, and dyes. (BB)

  8. Process chemistry {ampersand} statistics quality assurance plan

    SciTech Connect

    Meznarich, H.K.

    1996-08-01

    This document provides quality assurance guidelines and quality control requirements for Process Chemistry and Statistics. This document is designed on the basis of Hanford Analytical Services Quality Assurance Plan (HASQAP) technical guidelines and is used for governing process chemistry activities.

  9. Enzyme activity in dialkyl phosphate ionic liquids

    SciTech Connect

    Thomas, M.F.; Dunn, J.; Li, L.-L.; Handley-Pendleton, J. M.; van der lelie, D.; Wishart, J. F.

    2011-12-01

    The activity of four metagenomic enzymes and an enzyme cloned from the straw mushroom, Volvariellavolvacea were studied in the following ionic liquids, 1,3-dimethylimidazolium dimethyl phosphate, [mmim][dmp], 1-ethyl-3-methylimidazolium dimethyl phosphate, [emim][dmp], 1-ethyl-3-methylimidazolium diethyl phosphate, [emim][dep] and 1-ethyl-3-methylimidazolium acetate, [emim][OAc]. Activity was determined by analyzing the hydrolysis of para-nitrobenzene carbohydrate derivatives. In general, the enzymes were most active in the dimethyl phosphate ionic liquids, followed by acetate. Generally speaking, activity decreased sharply for concentrations of [emim][dep] above 10% v/v, while the other ionic liquids showed less impact on activity up to 20% v/v.

  10. Ultimate biodegradation of dialkyl phthalate ester plasticizers

    SciTech Connect

    Lee, C.L.; Sinko, C.J.; Winkelmann, D.A.; Peterson, D.R.; Parkerton, T.F.

    1995-12-31

    Phthalate Esters (PEs) are primarily used as plasticizers in the polymer industry to impart the desired degree of flexibility to plastic products. The single isomer, di-2-ethylhexyl phthalate (DEHP) is the most common plasticizer. However, other commercially important PE plasticizers possess branched alkyl chains of a mixed isomeric nature. The purpose of this study was to compare the ultimate biodegradability of mixed isomer PEs dihexyl (DHP), diisoheptyl (DIHP), diisononyl (DINP), diisodecyl (DIDP), and diisoundecyl (DIUP) phthalate to DEHP using the standardized OECD test (301 F) which is based on mannometric respirometry. Ultimate biodegradation results after 28 days under unacclimated conditions at 25 C were as follows: DHP (80 {+-} 10%), DIHP (82 {+-} 13%), DEHP (63 {+-} 18%), DINP (70 {+-} 11%), DIDP (67 {+-} 13%), DUP (57 {+-} 14%). These data confirm the readily biodegradable nature of DEHP and mixed isomer PEs reported in previous studies and provide additional data to contradict the misperception that PEs are environmentally persistent. The influence of alkyl chain structure on the rate and extent of biodegradation observed in this and other biodegradation studies are discussed.

  11. Eleventh international symposium on radiopharmaceutical chemistry

    SciTech Connect

    1995-12-31

    This document contains abstracts of papers which were presented at the Eleventh International Symposium on Radiopharmaceutical Chemistry. Sessions included: radiopharmaceuticals for the dopaminergic system, strategies for the production and use of labelled reactive small molecules, radiopharmaceuticals for measuring metabolism, radiopharmaceuticals for the serotonin and sigma receptor systems, labelled probes for molecular biology applications, radiopharmaceuticals for receptor systems, radiopharmaceuticals utilizing coordination chemistry, radiolabelled antibodies, radiolabelling methods for small molecules, analytical techniques in radiopharmaceutical chemistry, and analytical techniques in radiopharmaceutical chemistry.

  12. Environmental Chemistry Update

    NASA Astrophysics Data System (ADS)

    1995-08-01

    111 pg, leading to a body fat concentration of about 40 ppt (12). Lithium Battery AdvancesRechargeable Power SourceRecent advances in lithium ion battery technology may allow these devices to become the rechargeable power source of choice in electric cars of the future. Due to their high voltage, they can store a large amount of energy per given mass or volume of battery. In the past, however, such batteries have been somewhat impractical because they had to be hermetically sealed and required nonaqueous electrolytes due to lithium's violent reaction with water. In the newly developed battery, the electrolyte is water that already contains a high concentration of Li+ ions; elemental lithium (present as LiMn2O4 in one electrode) is unreactive in this medium unless an external connection to the other electrode is made (13). Air-Pollution Control for Power PlantsA process called SNOX, which removes both NOx and SO2 from the flue gases produced by coal-fired power plants, has been developed and demonstrated. The nitrogen oxides are first reduced to N2. The resulting gas is then heated and catalytically oxidized to sulfur trioxide, which is then hydrated to sulfuric acid. More than 90% of the NOx and SO2 were removed from the flue gases in the demonstration held at an Ohio Edison plant (14). Literature Cited Williams, D. Nature 1994, 371, 556. Emsley, J. New Scientist 1994, (Oct 1), 14. McMichael, A. J. American Journal of Epidemiology 1994, 140, 489-499. Chemical and Engineering News 1994, (Oct 10), 5. Santee, M. L. Science 1995, 267, 849-852. Chemical and Engineering News 1994, (Nov 14). Solomon, S. Journal of Geophysical Research 1994, 99, 20491-20499. Wennberg, P. O. Science 1994, 266, 398-404. Viggiano, A. A. Science 1995, 267, 82-84. Summary in Chemistry and Engineering News 1995, (Jan 9), 23. Schottler, S. P.; Eisenreich, S. J. Environmental Science and Technology 1994, 28, 2228-2232. Lang, L. Environmental Health Perspectives 1993, 101, 578-583. Chemical and

  13. The Philosophy of Chemistry as a New Resource for Chemistry Education

    ERIC Educational Resources Information Center

    Lombardi, Olimpia; Labarca, Martin

    2007-01-01

    The philosophy of chemistry has offered new tools that can guide educators in deciding how to balance descriptive and theoretical chemistry. The philosophy of chemistry has positive effects on the way that chemistry is taught and learned and it also leads educators to reach a better understanding of their own scientific discipline.

  14. The Journal of Kitchen Chemistry: A Tool for Instructing the Preparation of a Chemistry Journal Article

    ERIC Educational Resources Information Center

    Meyers, Jonathan K.; LeBaron, Tyler W.; Collins, David C.

    2014-01-01

    Writing assignments are typically incorporated into chemistry courses in an attempt to enhance the learning of chemistry or to teach technical writing to chemistry majors. This work addresses the development of chemistry-major writing skills by focusing on the rigorous guidelines and conventions associated with the preparation of a journal…

  15. DanceChemistry: Helping Students Visualize Chemistry Concepts through Dance Videos

    ERIC Educational Resources Information Center

    Tay, Gidget C.; Edwards, Kimberly D.

    2015-01-01

    A visual aid teaching tool, the DanceChemistry video series, has been developed to teach fundamental chemistry concepts through dance. These educational videos portray chemical interactions at the molecular level using dancers to represent chemical species. Students reported that the DanceChemistry videos helped them visualize chemistry ideas in a…

  16. Moving Chemistry Education into 3D: A Tetrahedral Metaphor for Understanding Chemistry

    ERIC Educational Resources Information Center

    Mahaffy, Peter

    2006-01-01

    A new conceptual metaphor is proposed to enrich the description of chemistry education and support the many existing efforts to help students make connections with the chemistry found in textbooks. A widely used metaphor for chemistry education takes the shape of a planar triangle that highlights three thinking levels in learning chemistry such as…

  17. One-world chemistry and systems thinking

    NASA Astrophysics Data System (ADS)

    Matlin, Stephen A.; Mehta, Goverdhan; Hopf, Henning; Krief, Alain

    2016-05-01

    The practice and overarching mission of chemistry need a major overhaul in order to be fit for purpose in the twenty-first century and beyond. The concept of 'one-world' chemistry takes a systems approach that brings together many factors, including ethics and sustainability, that are critical to the future role of chemistry.

  18. Activities across Nation Mark National Chemistry Week.

    ERIC Educational Resources Information Center

    Carpenter, Ernest, Ed.; And Others

    1989-01-01

    Describes national and local activities done during National Chemistry Week including chemistry demonstrations, shopping center exhibits, contests, and museum exhibits. Discusses the supplementary material about chemistry in selected editions of 16 newspapers, "Solution for the Future." Presents many pictures showing those activities. (YP)

  19. Reaction-Map of Organic Chemistry

    ERIC Educational Resources Information Center

    Murov, Steven

    2007-01-01

    The Reaction-Map of Organic Chemistry lists all the most commonly studied reactions in organic chemistry on one page. The discussed Reaction-Map will act as another learning aide for the students, making the study of organic chemistry much easier.

  20. Supplemental Instruction in Physical Chemistry I

    ERIC Educational Resources Information Center

    Toby, Ellen; Scott, Timothy P.; Migl, David; Kolodzeji, Elizabeth

    2016-01-01

    Physical chemistry I at Texas A&M University is an upper division course requiring mathematical and analytical skills. As such, this course poses a major problem for many Chemistry, Engineering, Biochemistry and Genetics majors. Comparisons between participants and non-participants in Supplemental Instruction for physical chemistry were made…

  1. Undergraduate Chemistry Education: A Workshop Summary

    ERIC Educational Resources Information Center

    Sawyer, Keegan; Alper, Joe

    2014-01-01

    "Undergraduate Chemistry Education" is the summary of a workshop convened in May 2013 by the Chemical Science Roundtable of the National Research Council to explore the current state of undergraduate chemistry education. Research and innovation in undergraduate chemistry education has been done for many years, and one goal of this…

  2. A Discovery Chemistry Experiment on Buffers

    ERIC Educational Resources Information Center

    Kulevich, Suzanne E.; Herrick, Richard S.; Mills, Kenneth V.

    2014-01-01

    The Holy Cross Chemistry Department has designed and implemented an experiment on buffers as part of our Discovery Chemistry curriculum. The pedagogical philosophy of Discovery Chemistry is to make the laboratory the focal point of learning for students in their first two years of undergraduate instruction. We first pose questions in prelaboratory…

  3. Diversity and Periodicity: An Inorganic Chemistry Module.

    ERIC Educational Resources Information Center

    Huheey, James

    This book is one in a series of Interdisciplinary Approaches to Chemistry (IAC) designed to help students discover that chemistry is a lively science and actively used to pursue solutions to the important problems of today. It is expected for students to see how chemistry takes place continuously all around and to readily understand the daily…

  4. An Approach towards Teaching Green Chemistry Fundamentals

    ERIC Educational Resources Information Center

    van Arnum, Susan D.

    2005-01-01

    A useful metrics system for the assessment of the environmental impact of chemical processes is utilized to illustrate several of the principles of green chemistry. The use of this metrics system in conjunction with laboratory experiments in green chemistry would provide for reinforcement in both the theory and practice of green chemistry.

  5. Chemistry, A Syllabus for Secondary Schools.

    ERIC Educational Resources Information Center

    New York State Education Dept., Albany. Bureau of Secondary Curriculum Development.

    This is a 1971 reprint of the chemistry syllabus printed in 1966 for the state of New York. This course of study presents a modern view of chemistry suitable for pupils with a wide range of skills and abilities. The outline of topics provides the unifying principles of chemistry together with related facts. The principles included in the outline…

  6. ENVIRONMENTAL CHEMISTRY CAREERS IN GOVERNMENT AGENCIES

    EPA Science Inventory

    Careers in chemistry and chemistry related fields can be very rewarding and enriching. Being an environmental chemist for a government agency requires a broad background in the field of chemistry. A knowledge of the operation of several analytical and preparatory instruments is...

  7. Forensic Chemistry--A Symposium Collection.

    ERIC Educational Resources Information Center

    Journal of Chemical Education, 1985

    1985-01-01

    Presents a collection of articles to provide chemistry teachers with resource materials to add forensic chemistry units to their chemistry courses. Topics range from development of forensic science laboratory courses and mock-crime scenes to forensic serology and analytical techniques. (JN)

  8. Organic Chemistry Self Instructional Package 2: Methane.

    ERIC Educational Resources Information Center

    Zdravkovich, V.

    This booklet, one of a series of 17 developed at Prince George's Community College, Largo, Maryland, provides an individualized, self-paced undergraduate organic chemistry instruction module designed to augment any course in organic chemistry but particularly those taught using the text "Organic Chemistry" by Morrison and Boyd. The entire series…

  9. Greener Approaches to Undergraduate Chemistry Experiments.

    ERIC Educational Resources Information Center

    Kirchhoff, Mary, Ed.; Ryan, Mary Ann, Ed.

    This laboratory manual introduces the idea of Green Chemistry, which is the design of chemical products and processes that reduce or eliminate the use and generation of hazardous substances. Instructional samples are included to help teachers integrate green chemistry into the college chemistry curriculum. Each laboratory includes: (1) a…

  10. Affordances of Instrumentation in General Chemistry Laboratories

    ERIC Educational Resources Information Center

    Sherman, Kristin Mary Daniels

    2010-01-01

    The purpose of this study is to find out what students in the first chemistry course at the undergraduate level (general chemistry for science majors) know about the affordances of instrumentation used in the general chemistry laboratory and how their knowledge develops over time. Overall, students see the PASCO(TM) system as a useful and accurate…

  11. Introducing Green Chemistry in Teaching and Research.

    ERIC Educational Resources Information Center

    Collins, Terrence J.

    1995-01-01

    Describes key elements for the research and teaching components of green chemistry, an environmentally friendly approach to chemistry. Presents an outline of an introductory course to green chemistry and other efforts at Carnegie Mellon University to incorporate the environment in a fertile manner into teaching. (JRH)

  12. Organic Chemistry Self Instructional Package 17: Arenes.

    ERIC Educational Resources Information Center

    Zdravkovich, V.

    This booklet, one of a series of 17 developed at Prince George's Community College, Largo, Maryland, provides an individualized, self-paced undergraduate organic chemistry instruction module designed to augment any course in organic chemistry but particularly those taught using the text "Organic Chemistry" by Morrison and Boyd. The entire series…

  13. JCE Resources for Chemistry and Art

    NASA Astrophysics Data System (ADS)

    Jacobsen, Erica K.

    2001-10-01

    This annotated bibliography shares the best "pictures" of chemistry and art from past issues of the Journal of Chemical Education--many thousands of well-crafted words and articles that tie in with National Chemistry Week's 2001 theme, Celebrating Chemistry and Art.

  14. 42 CFR 493.929 - Chemistry.

    Code of Federal Regulations, 2014 CFR

    2014-10-01

    ... 42 Public Health 5 2014-10-01 2014-10-01 false Chemistry. 493.929 Section 493.929 Public Health... Proficiency Testing Programs by Specialty and Subspecialty § 493.929 Chemistry. The subspecialties under the specialty of chemistry for which a proficiency testing program may offer proficiency testing are...

  15. 42 CFR 493.931 - Routine chemistry.

    Code of Federal Regulations, 2013 CFR

    2013-10-01

    ... 42 Public Health 5 2013-10-01 2013-10-01 false Routine chemistry. 493.931 Section 493.931 Public... Proficiency Testing Programs by Specialty and Subspecialty § 493.931 Routine chemistry. (a) Program content and frequency of challenge. To be approved for proficiency testing for routine chemistry, a...

  16. 42 CFR 493.931 - Routine chemistry.

    Code of Federal Regulations, 2014 CFR

    2014-10-01

    ... 42 Public Health 5 2014-10-01 2014-10-01 false Routine chemistry. 493.931 Section 493.931 Public... Proficiency Testing Programs by Specialty and Subspecialty § 493.931 Routine chemistry. (a) Program content and frequency of challenge. To be approved for proficiency testing for routine chemistry, a...

  17. 42 CFR 493.929 - Chemistry.

    Code of Federal Regulations, 2010 CFR

    2010-10-01

    ... 42 Public Health 5 2010-10-01 2010-10-01 false Chemistry. 493.929 Section 493.929 Public Health... Proficiency Testing Programs by Specialty and Subspecialty § 493.929 Chemistry. The subspecialties under the specialty of chemistry for which a proficiency testing program may offer proficiency testing are...

  18. 42 CFR 493.929 - Chemistry.

    Code of Federal Regulations, 2011 CFR

    2011-10-01

    ... 42 Public Health 5 2011-10-01 2011-10-01 false Chemistry. 493.929 Section 493.929 Public Health... Proficiency Testing Programs by Specialty and Subspecialty § 493.929 Chemistry. The subspecialties under the specialty of chemistry for which a proficiency testing program may offer proficiency testing are...

  19. 40 CFR 158.2210 - Product chemistry.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 24 2014-07-01 2014-07-01 false Product chemistry. 158.2210 Section... REQUIREMENTS FOR PESTICIDES Antimicrobial Pesticide Data Requirements § 158.2210 Product chemistry. The product chemistry data requirements of subpart D of this part apply to antimicrobial products covered by...

  20. 42 CFR 493.929 - Chemistry.

    Code of Federal Regulations, 2012 CFR

    2012-10-01

    ... 42 Public Health 5 2012-10-01 2012-10-01 false Chemistry. 493.929 Section 493.929 Public Health... Proficiency Testing Programs by Specialty and Subspecialty § 493.929 Chemistry. The subspecialties under the specialty of chemistry for which a proficiency testing program may offer proficiency testing are...

  1. 42 CFR 493.931 - Routine chemistry.

    Code of Federal Regulations, 2012 CFR

    2012-10-01

    ... 42 Public Health 5 2012-10-01 2012-10-01 false Routine chemistry. 493.931 Section 493.931 Public... Proficiency Testing Programs by Specialty and Subspecialty § 493.931 Routine chemistry. (a) Program content and frequency of challenge. To be approved for proficiency testing for routine chemistry, a...

  2. 42 CFR 493.929 - Chemistry.

    Code of Federal Regulations, 2013 CFR

    2013-10-01

    ... 42 Public Health 5 2013-10-01 2013-10-01 false Chemistry. 493.929 Section 493.929 Public Health... Proficiency Testing Programs by Specialty and Subspecialty § 493.929 Chemistry. The subspecialties under the specialty of chemistry for which a proficiency testing program may offer proficiency testing are...

  3. 42 CFR 493.931 - Routine chemistry.

    Code of Federal Regulations, 2010 CFR

    2010-10-01

    ... 42 Public Health 5 2010-10-01 2010-10-01 false Routine chemistry. 493.931 Section 493.931 Public... Proficiency Testing Programs by Specialty and Subspecialty § 493.931 Routine chemistry. (a) Program content and frequency of challenge. To be approved for proficiency testing for routine chemistry, a...

  4. 40 CFR 158.2210 - Product chemistry.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 25 2013-07-01 2013-07-01 false Product chemistry. 158.2210 Section... REQUIREMENTS FOR PESTICIDES Antimicrobial Pesticide Data Requirements § 158.2210 Product chemistry. The product chemistry data requirements of subpart D of this part apply to antimicrobial products covered by...

  5. 42 CFR 493.931 - Routine chemistry.

    Code of Federal Regulations, 2011 CFR

    2011-10-01

    ... 42 Public Health 5 2011-10-01 2011-10-01 false Routine chemistry. 493.931 Section 493.931 Public... Proficiency Testing Programs by Specialty and Subspecialty § 493.931 Routine chemistry. (a) Program content and frequency of challenge. To be approved for proficiency testing for routine chemistry, a...

  6. Form and Function: An Organic Chemistry Module.

    ERIC Educational Resources Information Center

    Jarvis, Bruce; Mazzocchi, Paul

    This book is one in the series of Interdisciplinary Approaches to Chemistry (IAC) designed to help students discover that chemistry is a lively science and actively used to pursue solutions to the important problems of today. It is expected for students to see how chemistry takes place continuously all around and to readily understand the daily…

  7. Mineral Process Chemistry: A Special Study.

    ERIC Educational Resources Information Center

    Dudeney, A. W. L.

    1982-01-01

    Mineral Process Chemistry is one of the special study options of the Nuffield Advanced Science course in chemistry. Following general comments on mineral process chemistry, the subject matter of the option is described, focusing on copper and china clay. (Author/JN)

  8. National Chemistry Week 2002: Chemistry Keeps Us Clean JCE Resources for Chemistry and Cleaning

    NASA Astrophysics Data System (ADS)

    Jacobsen, Erica K.

    2002-10-01

    The claims of cleaning products and personal care items are known to many. National Chemistry Week 2002 makes use of this familiar subject with its theme of "Chemistry Keeps Us Clean". A look back through the Journal of Chemical Education yields many articles connected to this theme. Students can make soap, test the properties of various household cleaners, find out how vacuum cleaners work, and more - all in the name of chemistry. This annotated bibliography collects the best that past issues of the Journal of Chemical Education have to offer for use with this year's National Chemistry Week. Each article has been characterized as a demonstration, experiment, activity, informational, or software/video item; several fit in more than one classification. The most recent articles are listed first. Also included is an evaluation as to which levels the article may serve. Articles that appeared adaptable to other levels, but are not designed explicitly for those levels, are labeled "poss. h.s." "poss. elem.", and so forth.

  9. Atmospheric Chemistry Over Southern Africa

    NASA Technical Reports Server (NTRS)

    Gatebe, Charles K.; Levy, Robert C.; Thompson, Anne M.

    2011-01-01

    During the southern African dry season, regional haze from mixed industrial pollution, biomass burning aerosol and gases from domestic and grassland fires, and biogenic sources from plants and soils is worsened by a semi-permanent atmosphere gyre over the subcontinent. These factors were a driver of several major international field campaigns in the 1990s and early 2000s, and attracted many scientists to the region. Some researchers were interested in understanding fundamental processes governing chemistry of the atmosphere and interaction with climate change. Others found favorable conditions for evaluating satellite-derived measurements of atmospheric properties and a changing land surface. With that background in mind a workshop on atmospheric chemistry was held in South Africa. Sponsored by the International Commission for Atmospheric Chemistry and Global Pollution (ICACGP; http://www.icacgp.org/), the workshop received generous support from the South African power utility, Eskom, and the Climatology Research Group of the University of the Witwatersrand, Johannesburg, South Africa. The purpose of the workshop was to review some earlier findings as well as more recent findings on southern African climate vulnerability, chemical changes due to urbanization, land-use modification, and how these factors interact. Originally proposed by John Burrows, president of ICACGP, the workshop was the first ICACGP regional workshop to study the interaction of air pollution with global chemical and climate change. Organized locally by the University of the Witwatersrand, the workshop attracted more than 60 delegates from South Africa, Mozambique, Botswana, Zimbabwe, France, Germany, Canada, and the United States. More than 30 presentations were given, exploring both retrospective and prospective aspects of the science. In several talks, attention was focused on southern African chemistry, atmospheric pollution monitoring, and climate processes as they were studied in the field

  10. Chemistry-nuclear chemistry division. Progress report, October 1979-September 1980

    SciTech Connect

    Ryan, R.R.

    1981-05-01

    This report presents the research and development programs pursued by the Chemistry-Nuclear Chemistry Division of the Los Alamos National Laboratory. Topics covered include advanced analytical methods, atmospheric chemistry and transport, biochemistry, biomedical research, element migration and fixation, inorganic chemistry, isotope separation and analysis, atomic and molecular collisions, molecular spectroscopy, muonic x rays, nuclear cosmochemistry, nuclear structure and reactions, radiochemical separations, theoretical chemistry, and unclassified weapons research.

  11. Parallel chemistry in the 21st century.

    PubMed

    Long, Alan

    2012-09-01

    The tool chest of techniques, methodologies, and equipment for conducting parallel chemistry is larger than ever before. Improvements in the laboratory and developments in computational chemistry have enabled compound library design at the desks of medicinal chemists. This unit includes a brief background in combinatorial/parallel synthesis chemistry, along with a discussion of evolving technologies for both solid- and solution-phase chemistry. In addition, there are discussions on designing compound libraries, acquisition/procurement of compounds and/or reagents, the chemistry and equipment used for chemical production, purification, sample handling, and data analysis.

  12. Green chemistry, biofuels, and biorefinery.

    PubMed

    Clark, James H; Luque, Rafael; Matharu, Avtar S

    2012-01-01

    In the current climate of several interrelated impending global crises, namely, climate change, chemicals, energy, and oil, the impact of green chemistry with respect to chemicals and biofuels generated from within a holistic concept of a biorefinery is discussed. Green chemistry provides unique opportunities for innovation via product substitution, new feedstock generation, catalysis in aqueous media, utilization of microwaves, and scope for alternative or natural solvents. The potential of utilizing waste as a new resource and the development of integrated facilities producing multiple products from biomass is discussed under the guise of biorefineries. Biofuels are discussed in depth, as they not only provide fuel (energy) but are also a source of feedstock chemicals. In the future, the commercial success of biofuels commensurate with consumer demand will depend on the availability of new green (bio)chemical technologies capable of converting waste biomass to fuel in a context of a biorefinery. PMID:22468603

  13. (Chemistry of the global atmosphere)

    SciTech Connect

    Marland, G.

    1990-09-27

    The traveler attended the conference The Chemistry of the Global Atmosphere,'' and presented a paper on the anthropogenic emission of carbon dioxide (CO{sub 2}) to the atmosphere. The conference included meetings of the International Global Atmospheric Chemistry (IGAC) programme, a core project of the International Geosphere/Biosphere Programme (IGBP) and the traveler participated in meetings on the IGAC project Development of Global Emissions Inventories'' and agreed to coordinate the working group on CO{sub 2}. Papers presented at the conference focused on the latest developments in analytical methods, modeling and understanding of atmospheric CO{sub 2}, CO, CH{sub 4}, N{sub 2}O, SO{sub 2}, NO{sub x}, NMHCs, CFCs, and aerosols.

  14. Amphoteric Aqueous Hafnium Cluster Chemistry.

    PubMed

    Goberna-Ferrón, Sara; Park, Deok-Hie; Amador, Jenn M; Keszler, Douglas A; Nyman, May

    2016-05-17

    Selective dissolution of hafnium-peroxo-sulfate films in aqueous tetramethylammonium hydroxide enables extreme UV lithographic patterning of sub-10 nm HfO2 structures. Hafnium speciation under these basic conditions (pH>10), however, is unknown, as studies of hafnium aqueous chemistry have been limited to acid. Here, we report synthesis, crystal growth, and structural characterization of the first polynuclear hydroxo hafnium cluster isolated from base, [TMA]6 [Hf6 (μ-O2 )6 (μ-OH)6 (OH)12 ]⋅38 H2 O. The solution behavior of the cluster, including supramolecular assembly via hydrogen bonding is detailed via small-angle X-ray scattering (SAXS) and electrospray ionization mass spectrometry (ESI-MS). The study opens a new chapter in the aqueous chemistry of hafnium, exemplifying the concept of amphoteric clusters and informing a critical process in single-digit-nm lithography.

  15. Theoretical Modeling of Interstellar Chemistry

    NASA Technical Reports Server (NTRS)

    Charnley, Steven

    2009-01-01

    The chemistry of complex interstellar organic molecules will be described. Gas phase processes that may build large carbon-chain species in cold molecular clouds will be summarized. Catalytic reactions on grain surfaces can lead to a large variety of organic species, and models of molecule formation by atom additions to multiply-bonded molecules will be presented. The subsequent desorption of these mixed molecular ices can initiate a distinctive organic chemistry in hot molecular cores. The general ion-molecule pathways leading to even larger organics will be outlined. The predictions of this theory will be compared with observations to show how possible organic formation pathways in the interstellar medium may be constrained. In particular, the success of the theory in explaining trends in the known interstellar organics, in predicting recently-detected interstellar molecules, and, just as importantly, non-detections, will be discussed.

  16. The chemistry of planetary atmospheres

    NASA Technical Reports Server (NTRS)

    Huntress, W. T., Jr.

    1976-01-01

    Present knowledge concerning the chemistry of planetary atmospheres is reviewed along with the theories which attempt to explain observational data. The known gross atmospheric compositions of the terrestrial and giant planets are listed, differences between the atmospheres of earth and Venus are discussed, and the atmospheres of the giant planets are described. The origin and evolution of the atmospheres of earth, Venus, Mars, Jupiter, Saturn, and Uranus are outlined, and chemical processes in the atmospheres are examined, particularly cloud formation. The question of organic synthesis and evolution in the reducing atmospheres of the giant planets is considered. It is noted that laboratory work on the individual chemical processes and reactions involved in the evolution of organic compounds in planetary atmospheres, comets, and interstellar space points to the inevitability of organic-compound synthesis in all these situations and to the pervasiveness of organic chemistry throughout the universe.

  17. Making Chemistry Fun to Learn.

    PubMed

    Wu, Chun; Foos, Jordan

    2010-03-01

    The major challenge that confronts undergraduate chemical education in US is the gap between the high demands that learning requires and the low efforts that students make partially due to the lack of motivation. This paper reports strategies to ameliorate student learning in the following areas: application of friendly presentation, utilization of analogies and correlation with everyday life. The novelty lies in the attempt to incorporate new meanings into the existing platforms on publisher provided teaching resources by utilizing commercially available software tools. The paper aims to point out ways to effective knowledge delivery that can be implemented by other chemistry instructors. The goal is to make chemistry vivid and easy to understand in order to stimulate students' intellectual curiosity, which in turn leads to learning enhancement regardless of their career choices.

  18. Recent Advances in Azaborine Chemistry

    PubMed Central

    Campbell, Patrick G.; Marwitz, Adam J. V.

    2013-01-01

    The chemistry of organoboron compounds has been primarily dominated by their use as powerful reagents in synthetic organic chemistry. Recently, the incorporation of boron as part of a functional target structure has emerged as a useful way to generate diversity in organic compounds. A commonly applied strategy is the replacement of a CC unit with its isoelectronic BN unit. In particular, the BN/CC isosterism of the ubiquitous arene motif has undergone a renaissance in the past decade. The parent molecule of the 1,2-dihydro-1,2-azaborine family has now been isolated. New mono- and polycyclic BN heterocycles have been synthesized for potential use in biomedical and materials science applications. This review is a tribute to Dewar's first synthesis of a monocyclic 1,2-dihydro-1,2-azaborine 50 years ago and discusses recent advances in the synthesis and characterization of carbon(C)-boron(B)-nitrogen(N)-containing heterocycles. PMID:22644658

  19. Evolutionary models of interstellar chemistry

    NASA Technical Reports Server (NTRS)

    Prasad, Sheo S.

    1987-01-01

    The goal of evolutionary models of interstellar chemistry is to understand how interstellar clouds came to be the way they are, how they will change with time, and to place them in an evolutionary sequence with other celestial objects such as stars. An improved Mark II version of an earlier model of chemistry in dynamically evolving clouds is presented. The Mark II model suggests that the conventional elemental C/O ratio less than one can explain the observed abundances of CI and the nondetection of O2 in dense clouds. Coupled chemical-dynamical models seem to have the potential to generate many observable discriminators of the evolutionary tracks. This is exciting, because, in general, purely dynamical models do not yield enough verifiable discriminators of the predicted tracks.

  20. Green chemistry, biofuels, and biorefinery.

    PubMed

    Clark, James H; Luque, Rafael; Matharu, Avtar S

    2012-01-01

    In the current climate of several interrelated impending global crises, namely, climate change, chemicals, energy, and oil, the impact of green chemistry with respect to chemicals and biofuels generated from within a holistic concept of a biorefinery is discussed. Green chemistry provides unique opportunities for innovation via product substitution, new feedstock generation, catalysis in aqueous media, utilization of microwaves, and scope for alternative or natural solvents. The potential of utilizing waste as a new resource and the development of integrated facilities producing multiple products from biomass is discussed under the guise of biorefineries. Biofuels are discussed in depth, as they not only provide fuel (energy) but are also a source of feedstock chemicals. In the future, the commercial success of biofuels commensurate with consumer demand will depend on the availability of new green (bio)chemical technologies capable of converting waste biomass to fuel in a context of a biorefinery.