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Author(s):   Sekusak, S.; Cory, M.G.; Bartlett, R.J.; Sabljic, A.
Title:   Dual-Level Direct Dynamics of the Hydroxyl Radical Reaction with Ethane and Haloethanes: Toward a General Reaction Parameter Method
Journal:   J. Phys. Chem. A
Volume:   103
Page(s):   11394 - 11405
Year:   1999
Reference type:   Journal article
Squib:   1999SEK/COR11394-11405

Reaction:   n-C5H12 + ·OH → Other Products + H2O
Reaction order:   2
Temperature:   298 K
Rate expression:   2.42x10-12 [cm3/molecule s]
Category:  Theory
Data type:   Transition state theory
Comments:   The rate constant is estimated from General Reaction Parameter (GRP) Method, and is lower than the experimental value from 1989ATK1.

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