Author(s):   Li, Y.; Zhang, H.; Chen, Q. G.; Li, Z. S.
Title:   Theoretical study of the reaction of CH2XO (X = F, Cl, Br) radicals with the NO radical
Journal:   J. Mol. Model.
Volume:   19
Page(s):   1391 - 1397
Year:   2013
Reference type:   Journal article
Squib:   2013LI/ZHA1391-1397

Associated entries:

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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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Squib	Reaction	Temp [K]	A	n	Ea [J/mole]	k(298.00 K)	Order
2013LI/ZHA1391-1397	NO + CH₂FO(.) → HFCO + HNO	200 - 1500	1.08E-14	1.83	-1.45E04	3.81E-12	2
2013LI/ZHA1391-1397	NO + CH₂ClO → HC(O)Cl + HNO	200 - 1500	5.77E-15	2.19	-1.47E04	2.19E-12	2
2013LI/ZHA1391-1397	CH₂BrO + NO → HC(O)Br + HNO	200 - 1500	2.44E-15	2.20	-1.26E04	3.93E-13	2

Search returned 3 records.