PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

formaldehyde    729 Formaldehyde

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    #  Species Formula
   719 Beryllium hydroxideHBeO
   720 Beryllium oxideBe2O
   721 BO (Geo)BO
   722 Boron oxideBO
   723 HydroxyboraneH3BO
   724 Carbon monoxideCO
   725 Carbon monoxide (Geo)CO
   726 HCO, cationHCO
   727 HCOHCO
   728 Formaldehyde (Geo)CH2O
   729 Formaldehyde CH2O
   730 CH2OH, cationCH3O
   731 CH2OH, radicalCH3O
   732 Methoxy, radicalCH3O
   733 Methoxy, anionCH3O
   734 Methanol (Geo)CH4O
   735 MethanolCH4O
   736 Lithium methoxide (Geo)H3LiCO
   737 Lithium methoxideH3LiCO
   738 BH3COH3BCO
   739 BH3CO (Geo)H3BCO


ΔHf: -26.0 kcal/mol,     REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
Dipole: 2.3 Debye,     REF: R. D. Nelson, D. R. Lide, A. A. Maryott, Nat. Stand. Ref. Data Set., Natl. Bur. Stand. No. 10 (1967).
I.P.: 10.1 eV,     REF: R. D. Levin, S. G. Lias, "Ionization Potentials and Appearance Potential Measurements," 1971-1981, Natl. Stand. Ref. Data Ser., Natl. Bur. Stand. 71, (1982), Cat. No. C13.48:71.
  
 SYMMETRY PM7
Formaldehyde
 DR=NLM1967 D=2.33 I=10.1 IR=LLNBS82 HR=C&P1970 H=-25.95 CP=8.46 S=52.29
  O     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.20614535 +1    0.0000000 +0    0.0000000 +0     1     0     0
  H     1.09115835 +1  121.2760770 +1    0.0000000 +0     2     1     0
  H     1.09115835 +1  121.2760770 +1  180.0000000 +1     2     1     3