Theoretical study of the kinetics of reactions of the monohalogenated methanes with atomic chlorine

Ab initio calculations at the G2 level were used in a theoretical description of the kinetics and mechanism of the hydrogen abstraction reactions from fluoro-, chloro- and bromomethane by chlorine atoms. The profiles of the potential energy surfaces show that mechanism of the reactions under investi...

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Detalles Bibliográficos
Autores principales: Brudnik, Katarzyna, Twarda, Maria, Sarzyński, Dariusz, Jodkowski, Jerzy T.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer-Verlag 2012
Materias:
Original Paper
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3604598/
https://www.ncbi.nlm.nih.gov/pubmed/23239396
http://dx.doi.org/10.1007/s00894-012-1709-4

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3604598/
https://www.ncbi.nlm.nih.gov/pubmed/23239396
http://dx.doi.org/10.1007/s00894-012-1709-4

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