Newly proposed proton-abstraction roundabout with backside attack mechanism for the SN2 reaction at the nitrogen center in F− + NH2Cl-Reference-Cited by-同舟云学术

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Newly proposed proton-abstraction roundabout with backside attack mechanism for the SN2 reaction at the nitrogen center in F− + NH2Cl

Published:2018 Issue:17 Volume:20 Page:12106-12111
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Li Yongfang¹²³⁴,Wang Dunyou¹²³⁴^ORCID

Affiliation:

1. College of Physics and Electronics

2. Shandong Normal University

3. Jinan

4. China

Abstract

Two novel reaction mechanisms are revealed for the S_N2 reaction at the nitrogen center in the F⁻ + NH₂Cl reaction.

Funder

National Natural Science Foundation of China

Taishan Scholar Foundation of Shandong Province

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2018/CP/C8CP01201F

Reference48 articles.

1. Gas phase nucleophilic substitution

2. Simulations of Gas-Phase Chemical Reactions: Applications to S N 2 Nucleophilic Substitution

3. Chemical Dynamics Simulations of X– + CH3Y → XCH3 + Y– Gas-Phase SN2 Nucleophilic Substitution Reactions. Nonstatistical Dynamics and Nontraditional Reaction Mechanisms

4. An ab initio investigation into the SN2 reaction: Frontside attack versus backside attack in the reaction of F? with CH3F

5. Nucleophilicity and Leaving-Group Ability in Frontside and Backside SN2 Reactions

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3. Theoretical Studies on OH⁻+NH₂Cl Reaction: Nucleophilic Substitution at Neutral Nitrogen;Journal of Computational Biophysics and Chemistry;2022-12-23

4. Atomic-Level Mechanism, Solvent Effect, and Potential of the Mean Force of the F^– + CH₃CH₂Cl S_N2 Reaction in Aqueous Solution;The Journal of Physical Chemistry A;2022-08-10

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