Accuracy

acetate, anion   1053 Acetate, anion

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    #  Species Formula
  1043 LiBO2LiBO2
  1044 O-B-B-OB2O2
  1045 O-B-B-O (Geo)B2O2
  1046 Carbon dioxideCO2
  1047 Carbon dioxide (Geo)CO2
  1048 Formate, anionHCO2
  1049 Formic acidCH2O2
  1050 Formic acid (Geo)CH2O2
  1051 trans Glyoxal (Geo)C2H2O2
  1052 trans GlyoxalC2H2O2
  1053 Acetate, anion C2H3O2
  1054 Acetic acidC2H4O2
  1055 Methyl formate (Geo)C2H4O2
  1056 Methyl formateC2H4O2
  1057 Dimethyl peroxideC2H6O2
  1058 Ethylene glycolC2H6O2
  1059 H2O - CH3OCH3 (Geo)C2H8O2
  1060 DimethoxyboraneH7BC2O2
  1061 Carbon suboxide (Geo)C3O2
  1062 Carbon suboxideC3O2
  1063 2-Oxo-propanalC3H4O2


ΔHf: -122.5 kcal/mol,     REF: J. E. Bartmess, R. T. McIver, "Gas Phase Ion Chemistry," Academic Press, New York, 1979, Vol. II.
  
 CHARGE=-1 PM7
Acetate, anion
 H=-122.5 103.3 HR=BM1979
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.56280159 +1    0.0000000 +0    0.0000000 +0     1     0     0
  H     1.08640115 +1  108.7394258 +1    0.0000000 +0     2     1     0
  H     1.08639292 +1  108.9337834 +1  118.8707554 +1     2     1     3
  H     1.08642925 +1  109.9532295 +1 -120.4559738 +1     2     1     3
  O     1.23778581 +1  115.8754865 +1  117.0624559 +1     1     2     3
  O     1.23828897 +1  115.5280855 +1  -62.8686483 +1     1     2     3