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Author(s):   Sivaramakrishnan, R.;Tranter, R.S.;Brezinsky, K.
Title:   High pressure pyrolysis of toluene. 1. Experiments and modeling of toluene decomposition
Journal:   J. Phys. Chem. A
Volume:   110
Page(s):   9388 - 9399
Year:   2006
Reference type:   Journal article
Squib:   2006SIV/TRA9388-9399

Reaction:   TolueneBenzyl +
Reaction order:   1
Temperature:   1027 - 1897 K
Rate expression:   1.11x1016 [s-1] e-390769 [J/mole]/RT
Category:  Theory
Data type:   Derived from detailed balance/reverse rate
Pressure dependence:   Rate constant is high pressure limit
Comments:   Rate constant values were determined from combinig theoretical rate constanst for the reverse reaction and critically evaluated value of reaction enthalpy.

View full bibliographic record.


Rate constant values calculated from the Arrhenius expression:

T (K)k(T) [s-1]
1027 1.49E-4
1050 4.05E-4
1100 3.10E-3
1150 1.98E-2
1200 1.09E-1
1250 5.22E-1
1300 2.22E0
1350 8.45E0
1400 2.93E1
1450 9.33E1
1500 2.75E2
1550 7.55E2
1600 1.95E3
1650 4.74E3
1700 1.10E4
1750 2.42E4
1800 5.09E4
1850 1.03E5
1897 1.94E5