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Reaction kinetics of 1,4-cyclohexadienes with OH radicals: an experimental and theoretical study.
Giri BR, V-T Mai T, Assali M, Nguyen TT, Nguyen HT, Szőri M, Huynh LK, Fittschen C, Farooq A. Giri BR, et al. Phys Chem Chem Phys. 2022 Mar 30;24(13):7836-7847. doi: 10.1039/d1cp04964j. Phys Chem Chem Phys. 2022. PMID: 35297923
The computed energy profile revealed that the reaction proceeds via the formation of a pre-reaction van der Waals complex at the entrance channel. The complex was found to be more stable than that usually seen in other alkenes + OH reactions. ...
The computed energy profile revealed that the reaction proceeds via the formation of a pre-reaction van der Waals complex at the entr …