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Racing Carbon Atoms. Atomic Motion Reaction Coordinates and Structural Effects on Newtonian Kinetic Isotope Effects

[Image: see text] Intramolecular (13)C kinetic isotope effects were determined for the dimerization of methacrolein. Trajectory studies accurately predict the isotope effects and support an origin in Newton’s second law of motion, with no involvement of zero-point energy or transition state recrossi...

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Detalhes bibliográficos
Main Authors: Andujar-De Sanctis, Ivonne L., Singleton, Daniel A.
Formato: Artigo
Idioma:Inglês
Publicado em: 2012
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3490209/
https://ncbi.nlm.nih.gov/pubmed/23025278
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ol302389f
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