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Author(s):   Gu, X.B.; Zhang, F.T.; Kaiser, R.I.; Kislov, V.V.; Mebel, A.M.
Title:   Reaction dynamics of the phenyl radical with 1,2-butadiene
Journal:   Chem. Phys. Lett.
Volume:   474
Page(s):   51 - 56
Year:   2009
Reference type:   Journal article
Squib:   2009GU/ZHA51-56

Reaction:   1,2-butadiene + PhenylIndene + ·CH3
Reaction order:   2
Rate expression:   no rate data available
Category:  Theory
Data type:   Ab initio
Comments:   Reaction potential energy surface was studied using quantum chemistry and product channels were analyzed. No rate constant values were calculated.

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