Concepedia

Potential energy surface stationary points and dynamics of the F<sup>−</sup>+ CH<sub>3</sub>I double inversion mechanism

Yongtao Ma, Xinyou Ma, Anyang Li, Hua Guo, Li Yang, Jiaxu Zhang, William L. Hase

Physical Chemistry Chemical Physics · 2017 · 35 citations · 51 references

DOI

Concepts

Abstract

Direct dynamics simulations were performed to study the S<sub>N</sub>2 double inversion mechanism S<sub>N</sub>2-DI, with retention of configuration, for the F<sup>−</sup>+ CH<sub>3</sub>I reaction.

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