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Author(s):   Francisco-Marquez, M.; Alvarez-Idaboy, J.R.; Galano, A.; Vivier-Bunge, A.
Title:   On the role of s-cis conformers in the reaction of dienes with OH radicals
Journal:   Phys. Chem. Chem. Phys.
Volume:   6
Page(s):   2237 - 2244
Year:   2004
Reference type:   Journal article
Squib:   2004FRA/ALV2237-2244

Reaction:   1,3-Butadiene + ·OH → Adduct
Reaction order:   2
Temperature:   298 K
Rate expression:   2.51x10-11 [cm3/molecule s]
Category:  Theory
Data type:   Ab initio
Pressure dependence:   Rate constant is high pressure limit
Comments:   Rate constants calculated using Transition State Theory from ab initio parameters.

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