PM7 Accuracy

propanamide    933 Propanamide

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    #  Species Formula
   923 FormamideCH3NO
   924 Formamide (Geo)CH3NO
   925 AcetaldoximeC2H5NO
   926 AcetamideC2H5NO
   927 IsoxazoleC3H3NO
   928 OxaloneC3H3NO
   929 AcrylamineC3H5NO
   930 MethoxyacetonitrileC3H5NO
   931 DimethylformamideC3H7NO
   932 N-Methyl acetamideC3H7NO
   933 Propanamide C3H7NO
   934 DimethylaminomethanolC3H9NO
   935 3-Methyl isoxazoleC4H5NO
   936 5-Methyl isoxazoleC4H5NO
   937 2-PyrrolidinoneC4H7NO
   938 4,5-Dihydro-2-methyl oxazoleC4H7NO
   939 MethacrylamideC4H7NO
   940 2-Methyl propanamideC4H9NO
   941 ButanamideC4H9NO
   942 IsobutylamideC4H9NO
   943 N,N-dimethyl acetamideC4H9NO


DHf: -61.9 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 PM7
Propanamide
 H=-61.89 HR=NIST
  O     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.21157569  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.51152427  1  124.9484963  1    0.0000000  0     2     1     0
  C     1.52490403  1  109.9049362  1    0.0810090  1     3     2     1
  N     1.38835657  1  118.9665347  1 -179.9967205  1     2     1     3
  H     1.10904960  1  110.0916024  1 -121.6671017  1     3     2     4
  H     1.10916441  1  110.0825728  1 -116.7267320  1     3     2     6
  H     1.09912528  1  111.2976174  1  -59.5521042  1     4     3     2
  H     1.09925009  1  111.2936449  1  118.1899432  1     4     3     8
  H     1.09459026  1  111.6917491  1  120.8942018  1     4     3     9
  H     0.99156775  1  123.4639368  1  179.9974161  1     5     2     1
  H     1.00015758  1  119.6111222  1 -179.9984287  1     5     2    11