diff --git a/input/kinetics/families/R_Addition_MultipleBond/rules.py b/input/kinetics/families/R_Addition_MultipleBond/rules.py index 422d4d41e4..d6170b6ebf 100644 --- a/input/kinetics/families/R_Addition_MultipleBond/rules.py +++ b/input/kinetics/families/R_Addition_MultipleBond/rules.py @@ -40459,7 +40459,7 @@ entry( index = 3201, - label = "N3t_N3t;CH_quartet", + label = "N3t_N3t;CH_doublet", kinetics = ArrheniusEP( A = (3.6e+28, 'cm^3/(mol*s)'), n = -5.84, @@ -40473,6 +40473,7 @@ longDesc = u""" Added by Beat Buesser, value for reaction: CH + N2 = HCNN (B&D #24a) in 'Gas-Phase Combustion Chemistry' (ISBN: 978-1-4612-7088-1), chapter 2, 'Combustion Chemistry of Nitrogen', Anthony M. Dean, Joseph W. Bozzelli", +Here CH is in its ground state (doublet), as specified in B&D p. 221: The initially formed adduct from CH+N2 is a doublet, and there's a surface crossing to eventually form HCN + N. """, )