Ab initio kinetics of the CH3NH + NO2 reaction: formation of nitramines and N-alkyl nitroxides-Reference-Cited by-同舟云学术

Ab initio kinetics of the CH₃NH + NO₂ reaction: formation of nitramines and N-alkyl nitroxides

Published:2023 Issue:46 Volume:25 Page:31936-31947
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Nguyen Loc T.¹²^ORCID,Mai Tam V.-T.³⁴,Vien Huy D.¹²,Nguyen Trang T.¹²^ORCID,Huynh Lam K.¹²^ORCID

Affiliation:

1. School of Chemical and Environmental Engineering, International University, Quarter 6, Linh Trung Ward, Thu Duc City, Ho Chi Minh City, Vietnam

2. Vietnam National University, Ho Chi Minh City, Vietnam

3. Institute of Fundamental and Applied Sciences, Duy Tan University, 06 Tran Nhat Duat, Tan Dinh Ward, District 1, Ho Chi Minh City, Vietnam

4. Faculty of Natural Sciences, Duy Tan University, Da Nang City, Vietnam

Abstract

The gas-phase reaction of CH3NH with NO2 is meticulously investigated by quantum chemistry calculation and kinetic modeling to thoroughly understand the potential transformation of CH3NH in the atmosphere.

Funder

Viet Nam National University Ho Chi Minh City

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2023/CP/D3CP03333C

Reference73 articles.

1. Emission of aliphatic amines from animal husbandry and their reactions: Potential source of N2O and HCN

2. Atmospheric amines – Part I. A review

3. Atmospheric amines – Part II. Thermodynamic properties and gas/particle partitioning

4. Isocyanic acid in the atmosphere and its possible link to smoke-related health effects

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