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Title: Computational study of the kinetics of hydrogen abstraction from fluoromethanes by the hydroxyl radical
Journal: J. Phys. Chem. A
Volume: 102
Page(s): 10074 - 10081
Year: 1998
Reference type: Journal article
Squib: 1998SCH/MAR10074-10081
Reaction:
CH3F + ·OH → ·CH2F + H2O
Reaction order:
2
Temperature:
200 - 2500
K
Rate expression:
7.35x10-14 [cm3/molecule s] (T/298 K)3.35 e-3060 [J/mole]/RT
Category: Theory
Data type:
Transition state theory
View full bibliographic record.
Rate constant values calculated from the Arrhenius expression:
| T (K) | k(T) [cm3/molecule s] |
|---|---|
| 200 | 3.07E-15 |
| 300 | 2.20E-14 |
| 400 | 7.85E-14 |
| 500 | 1.99E-13 |
| 600 | 4.15E-13 |
| 700 | 7.59E-13 |
| 800 | 1.27E-12 |
| 900 | 1.98E-12 |
| 1000 | 2.94E-12 |
| 1100 | 4.18E-12 |
| 1200 | 5.75E-12 |
| 1300 | 7.70E-12 |
| 1400 | 1.01E-11 |
| 1500 | 1.29E-11 |
| 1600 | 1.63E-11 |
| 1700 | 2.02E-11 |
| 1800 | 2.48E-11 |
| 1900 | 3.00E-11 |
| 2000 | 3.60E-11 |
| 2100 | 4.27E-11 |
| 2200 | 5.03E-11 |
| 2300 | 5.89E-11 |
| 2400 | 6.83E-11 |
| 2500 | 7.88E-11 |