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Author(s):   Lee, E.PF.; Dyke, J.M.; Chow, W.K.; Chau, F.T.; Mok, D.KW.
Title:   DFT and ab initio calculations on two reactions between hydrogen atoms and the fire suppressants 2-H heptafluoropropane and CF3Br
Journal:   J. Comput. Chem.
Volume:   28
Page(s):   1582 - 1592
Year:   2007
Reference type:   Journal article
Squib:   2007LEE/DYK1582-1592

Associated entries:

Search Results

Rate expression:  k(T) = A (T/298 K)n e-Ea/RT
Rate expression units:
First order:  s-1
Second order:  cm3/molecule s
Third order:  cm6/molecule2 s
R = 8.314472 J / mole K
Energy Units J   Molecular Units Molecule
Pressure Units bar   Temperature Units K
Base Volume Unit cm   Reference Temperature 298.0
Evaluation Temperature 298.0

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Plot   Squib   Reaction   Temp [K]   A   n   Ea [J/mole]   k(298.00 K)   Order
    2007LEE/DYK1582-1592   CF3Br + H· → ·CF3 + HBr                     2
    2007LEE/DYK1582-1592   CF3CHFCF3 + H· → H2 + (CF3)2CF                     2
Search returned 2 records.