Dynamic exit-channel pathways of the microsolvated HOO−(H2O) + CH3Cl SN2 reaction: Reaction mechanisms at the atomic level from direct chemical dynamics simulations-Reference-Cited by-同舟云学术

Dynamic exit-channel pathways of the microsolvated HOO−(H2O) + CH3Cl SN2 reaction: Reaction mechanisms at the atomic level from direct chemical dynamics simulations

Published:2018-01-07 Issue:1 Volume:148 Page:014302
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

Yu Feng¹^ORCID

Affiliation:

1. Department of Physics, School of Science, Xi’an Technological University, No. 4 Jinhua North Road, Xi’an, Shaanxi 710032, China

Funder

National Natural Science Foundation of China

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.5000400

Reference88 articles.

1. Gas-Phase Ionic Reactions: Dynamics and Mechanism of Nucleophilic Displacements

2. Gas phase nucleophilic substitution

3. Thermochemistry and structures of solvated SN2 complexes and transition states in the gas phase: experiment and theory

4. S. M. Bachrach, Computational Organic Chemistry (John Wiley & Sons, New Jersey, 2007), p. 296.

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