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Author(s):   Hou, H.;Li, Y.Z.;Wang, B.S.
Title:   Computational study of the reaction of atomic oxygen with acetone in the gas phase
Journal:   J. Phys. Chem. A
Volume:   110
Page(s):   13163 - 13171
Year:   2006
Reference type:   Journal article
Squib:   2006HOU/LI13163-13171

Reaction:   (CH3)2CO + ·CH3 + CH3C(O)O
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. Rate constant values were calculated but not reported. This channel is minor (less than 1%) at all temperatures up to 3000 K.

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