Potential Energy Surfaces of the Gas-Phase Sn2 Reactions X- + CH3X = XCH3 + X- (X=F, Cl, Br, I): A Comparative Study by Density Functional Theory and ab Initio Methods

L. Deng, V. Branchadell, T. Ziegler

Research output: Contribution to journalArticleResearch

168 Citations (Scopus)
Original languageEnglish
Pages (from-to)10645-10656
JournalJ. Am. Chem. Soc.
Issue number116
Publication statusPublished - 1 Jan 1994

Cite this