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Chemical Physics Letters(2)
International Journal of Quantum Chemistry(2)
Computational and Theoretical Chemistry(1)
Molecules(1)
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Estudio de la reactividad del cloronitrobenceno en la sustitución nucleofílica de Vicarius
Bachelor ThesisAbstract: Se presenta un estudio experimental y computacional de la reactividad del cloronitrobenceno en la suPalabras claves:CLORONITROBENCENO, Cromatografía, ELECTROFÍLICA AROMÁTICA, GAUSS VIEW 4.1.2, REACTIVIDAD, SUSTITUCIÓN NUCLEOFÍLICA, Termodinámica, VICARIUSAutores:Lorena Maribel Meneses-Olmedo, María Alejandra Castellanos LópezFuentes:rraaeOn the reaction mechanism of the 3,4-dimethoxybenzaldehyde formation from 1-(3',4'-Dimethoxyphenyl)Propene
ArticleAbstract: Lignin peroxidase (LiP) is an important enzyme for degrading aromatic hydrocarbons not only in naturPalabras claves:1-(3'4'-dimethoxyphenyl) propene, 3,4-dimethoxybenzaldehyde, DFT, Force constant, Lignin peroxidase, Reaction force, reaction mechanismAutores:Alzate-Morales J., Felipe E. Gallegos, Josefa Arias, Lorena Maribel Meneses-Olmedo, Sebastian CuestaFuentes:scopusInsights on the mechanism, reactivity and selectivity of fructose and tagatose dehydration into 5-hydroxymethylfurfural: A DFT study
ArticleAbstract: In this study, a computational DFT study was performed to propose a new acid catalyzed mechanism toPalabras claves:BIOMASS, Force quantum descriptor, fructose, Tagatose, TautomerizationAutores:Cardona Villada W., Gerli L., Lorena Maribel Meneses-Olmedo, Mendoza-Huizar L.H., Salgado Moran G., Sebastián Cuesta HoyosFuentes:scopusLocal hardness: An application to electrophilic additions
ArticleAbstract: The electrophilic addition of hydrogen chloride in substituted ethylenes has been revised by using tPalabras claves:Autores:Araya A., Contreras R., Fernanda Pilaquinga F．, Fuentealba P., Lorena Maribel Meneses-Olmedo, Lorena MenesesFuentes:googlescopusUnveiling the structure-reactivity relationship involved in the reaction mechanism of the HCl-catalyzed alkyl t-butyl ethers thermal decomposition. A computational study
ArticleAbstract: The gas-phase thermal decomposition of a series of alkyl t-butyl ethers catalyzed by hydrogen chloriPalabras claves:ethers decomposition, hydrogen chloride, reaction mechanism, structure-reactivity relationshipAutores:César H. Zambrano, Fernando Javier Torres, Flores-Morales V., Jose R. Mora, Lorena Maribel Meneses-Olmedo, Luis Rincon, Marquez E.A., Sebastian CuestaFuentes:scopusRelationship between the electrophilicity and σ<inf>p</inf> Hammett constant in Baeyer-Villiger reactions
ArticleAbstract: The Baeyer-Villiger oxidation of some aldehydes and ketones has been revised by using the electrophiPalabras claves:Autores:Araya A., Fernanda Pilaquinga F．, Fuentealba P., Lorena Maribel Meneses-OlmedoFuentes:scopusRelationship between the electrophilicity of substituting agents and substrate selectivity in Friedel-Crafts reactions
ArticleAbstract: The global electrophilicity index evaluated at the ground state of benzylating and acylating agentsPalabras claves:Electrophilic activation/deactivation in Friedel-Crafts reactions, Electrophilicity and substrate selectivity, Electrophilicity indexAutores:Contreras R., Fuentealba P., Lorena Maribel Meneses-OlmedoFuentes:scopusTheoretical studies of reactivity and selectivity in some organic reactions
Conference ObjectAbstract: Some organic reactions with biological or commercial interest have been studied by using reactivityPalabras claves:DFT, Reactivity, SelectivityAutores:Araya A., Carrillo P., Espín M., Fernanda Pilaquinga F．, Lorena Maribel Meneses-Olmedo, Lorena Meneses, Sánchez F.Fuentes:googlescopus