Free-Energy Surfaces for Liquid-Phase Reactions and their Use to Study the Border Between Concerted and Nonconcerted α, β-Elimination Reactions of Esters and …

Y Kim, JR Mohrig, DG Truhlar

Index: Marshall,D.R. et al. Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1977 , p. 1914 - 1919

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Citation Number: 39

Abstract

... Journal of the ... 2010, 132 (32), pp 11071–11082. DOI: 10.1021/ja101104q. Publication Date (Web): July 26, 2010. Copyright © 2010 American Chemical Society. ... All four reactions lead to a product alkene in which the methyl group is trans (E) to the carbonyl, but the systematic ...