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Elucidating the Catalytic Role of Mg(II) in the Intramolecular Proton Transfer Reaction in Thymine

In the framework of the reaction force analysis a study of the mechanism of the 1-3 intramolecular proton transfer in free and Mg (II) coordinated Thymine was done in terms of the reaction electronic flux and Wiberg bond orders. Profiles of these properties evidentiated differences between the proto...

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Detalhes bibliográficos
Publicado no:Journal of the Mexican Chemical Society
Main Authors: Stefan Vogt-Geisse, Soledad Gutiérrez-Oliva, Bárbara Herrera, Alejandro Toro-Labbé
Formato: Artigo
Idioma:Inglês
Publicado em: Sociedad Química de México 2012
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Acesso em linha:https://www.redalyc.org/articulo.oa?id=47524533018
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