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

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

Department of Chemistry

Research output: Contribution to journal › Article › Research

Original language	English
Pages (from-to)	10645-10656
Journal	J. Am. Chem. Soc.
Volume	0
Issue number	116
Publication status	Published - 1 Jan 1994

Cite this

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title = "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",

author = "L. Deng and V. Branchadell and T. Ziegler",

year = "1994",

month = jan,

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language = "English",

volume = "0",

pages = "10645--10656",

journal = "Journal of the American Chemical Society",

issn = "0002-7863",

publisher = "American Chemical Society",

number = "116",

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T1 - 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

AU - Deng, L.

AU - Branchadell, V.

AU - Ziegler, T.

PY - 1994/1/1

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M3 - Article

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VL - 0

SP - 10645

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JF - Journal of the American Chemical Society

IS - 116

ER -