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New insight into the chloroacetanilide herbicide degradation mechanism through a nucleophilic attack of hydrogen sulfide
ArticleAbstract: The nucleophilic attack of hydrogen sulfide (HS−) on six different chloroacetanilide herbicides wasPalabras claves:Computational modeling, density functional theory, herbicides, reaction mechanism, Transition stateAutores:Cristian Cervantes, Jose R. Mora, Marquez E.A.Fuentes:scopusTheoretical calculations of the multistep reaction mechanism involved in asparagine pyrolysis supported by degree of rate control and thermodynamic control analyses
ArticleAbstract: A computational study on the mechanisms of reaction for the pyrolysis of asparagine is presented. APalabras claves:asparagine, biomass pyrolysis, pyrolysis, reaction mechanismAutores:Alcázar J.J., Cristian Cervantes, Fernando Javier Torres, Jose R. Mora, Luis Rincon, Marquez E.A., Miguel Angel MéndezFuentes:googlescopusTheoretical study of the mechanism of 2,5-diketopiperazine formation during pyrolysis of proline
ArticleAbstract: In biomass pyrolysis reactions, the wide range of products obtained (some of them environmentally haPalabras claves:proline, pyrolysis, Reaction force, transition state, 2,5-diketopiperazineAutores:Cristian Cervantes, Jose R. Mora, Luis Rincon, Vladimir RodríguezFuentes:googlescopus