Tropospheric Reactions of Triazoles with Hydroxyl Radicals: Hydroxyl Addition is Faster than Hydrogen Abstraction

Derbel, N; Ferchichi, O; Alijah, A

Derbel, N (reprint author), Univ Tunis El Manar, Fac Sci, Dept Phys, LSAMA, Tunis 1060, Tunisia.

CHEMPHYSCHEM, 2018; 19 (14): 1789

Abstract

We present the results of a systematic investigation, at the BHandHLYP/AVTZ density functional (DFT) level, of the tautomeric equilibria of 1,2,3- and......

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