HClH TS     47 HClH TS

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    #  Species Formula
    37 1a Nitrous oxide and ethylene TSC2H4N2O
    38 H plus HF - HF plus H TSH2F
    39 H plus FCH3 - HF plus CH3 TSCH4F
    40 F-CH3-OH (-) TSCH4OF
    41 HOCH3F TS 2CH4OF
    42 OH(-) plus CH3F - HOCH3 plus F(-) TSCH4OF
    43 HF2 TSHF2
    44 FCH3F TS 1CH3F2
    45 EP(-) plus CH3O(-) TSC3H7O5P
    46 REP(-) plus CH3O(-) TSC5H9O6P
    47 HClH TS H2Cl
    48 CH3 plus FCl - CH3F plus Cl TSCH3FCl
    49 F - CH3 - Cl(-) TS, forward reactionCH3FCl
    50 FCH3Cl TS 1CH3FCl
    51 Cl-CH3-Cl (-) TSCH3Cl2
     1 H plus C2H4 - CH3CH2 TSC2H5
     2 CH3 plus C2H4 - CH3CH2CH2 TSC3H7
     3 hc1 - Ring-opening cyclobutene TSC4H6
     4 hc5 - Cyclobutadiene TSC5H6
     5 hc4 - Pentadiene TSC5H8
     6 hc2 - Hexatriene to cyclohexadiene TSC6H8


ΔHf: 18.0 kcal/mol,     REF: L. Goerigk and S. Grimme in J. Chem. Theory Comput. 2010, 6, 107-126. http://toc.uni-muenster.de/GMTKN/GMTKN24/BH76both.
  

      HClH TS
      H=18.0+"H plus HCl" hr=bh76
  H     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
 Cl     1.29089300  1    0.0000000  0    0.0000000  0     1     0     0
  H     1.54367000  1  130.0059740  1    0.0000000  0     2     1     0