Mostrando 7 resultados de: 7
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Journal of Physical Organic Chemistry(3)
Journal of Physical Chemistry A(2)
Journal of Computational Methods in Sciences and Engineering(1)
Journal of Molecular Structure: THEOCHEM(1)
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Mechanism of α-Amino Acids decomposition in the gas phase. Experimental and theoretical study of the elimination kinetics of N-Benzyl Glycine Ethyl Ester
ArticleAbstract: The gas-phase elimination kinetics of N-benzylglycine ethyl ester was examined in a static system, sPalabras claves:Autores:Chuchania G., Córdova-Sintjago T.C., Jose R. Mora, Oliveros J., Tosta M.Fuentes:googlescopusJoint experimental and DFT study of the gas-phase unimolecular elimination kinetic of methyl trifluoropyruvate
ArticleAbstract: The elimination kinetics of methyl trifluoropyruvate in the gas phase was determined in a static sysPalabras claves:Autores:Chuchania G., Córdova-Sintjago T.C., Jose R. Mora, Tosta M.Fuentes:googlescopusJoint theoretical and experimental study of the gas-phase elimination kinetics of tert-butyl ester of carbamic, N,N-dimethylcarbamic, N-hydroxycarbamic acids and 1-(tert-butoxycarbonyl)-imidazole
ArticleAbstract: The gas-phase elimination kinetics of the title compounds were carried out in a static reaction systPalabras claves:B3LYP/6-31G(d), B3LYP/6-31G(d,p) calculations, Gas-phase elimination, kinetics, mechanism, MP2/6-31G, Tert-butyl carbamatesAutores:Barroso J., Chuchania G., Córdova-Sintjago T.C., Dominguez R.M., Herize A., Jose R. Mora, Tosta M.Fuentes:scopusKinetics and mechanisms of gas-phase elimination of 2,2-diethoxyethyl amine and 2,2-diethoxy-N,n-diethylethanamine
ArticleAbstract: The gas-phase elimination kinetics of 2,2-diethoxyethyl amine and 2,2-diethoxy-N,N-diethylethanaminePalabras claves:2,2-diethoxy-N,N-diethylethanamine, 2,2-diethoxyethyl amine, Gas-phase elimination, kinetics, mechanismAutores:Chuchania G., Dominguez R.M., Herize A., Jose R. Mora, Tosta M.Fuentes:scopusQuantum chemical calculations of the homogeneous, unimolecular, gas-phase elimination kinetics of primary alkyl acetates and (dimethylamino)alkyl acetates: Neighboring group participation in 4-(dimethylamino)-1-butyl acetate
ArticleAbstract: The kinetics and mechanisms of the gas-phase elimination reaction of several alkyl and (dimethylaminPalabras claves:(Dimethylamino)alkyl acetates, Alkyl acetates, Gas-phase kinetics, mechanism, MP2 and DFT calculationsAutores:Chuchania G., Córdova-Sintjago T.C., Jose R. Mora, Tosta M.Fuentes:googlescopusThe mechanism of the homogeneous, unimolecular gas-phase elimination kinetic of 1,1-dimethoxycyclohexane: Experimental and theoretical studies
ArticleAbstract: The gas-phase elimination of 1,1-dimethoxycyclohexane yielded 1-methoxy-1-cyclohexene and methanol.Palabras claves:1,1-dimethoxycyclohexane, DFT calculations, kinetics, Unimolecular eliminationAutores:Chuchania G., Córdova-Sintjago T.C., Dominguez R.M., Jose R. Mora, Marquez E.A., Rosas F., Tosta M.Fuentes:scopusThe thermal decomposition of 4-bromobutyric acid in the gas phase: A quantum chemical theory calculation
Conference ObjectAbstract: The gas-phase elimination kinetic of 4-bromobutyric acid to give butyrolactone, and hydrogen bromidePalabras claves:4-bromobutyric acid, density functional theory, elimination kinetic, mechanismAutores:Chuchania G., Córdova-Sintjago T.C., Jose R. Mora, Tosta M.Fuentes:googlescopus