PM7 Accuracy

butanamide    941 Butanamide

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    #  Species Formula
   931 DimethylformamideC3H7NO
   932 N-Methyl acetamideC3H7NO
   933 PropanamideC3H7NO
   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 Butanamide C4H9NO
   942 IsobutylamideC4H9NO
   943 N,N-dimethyl acetamideC4H9NO
   944 N,N-Diethyl-hydroxylamineC4H11NO
   945 2-PyridinolC5H5NO
   946 3-PyridinolC5H5NO
   947 4-PyridinolC5H5NO
   948 Pyridine 1 oxideC5H5NO
   949 3,5-Dimethyl isoxazoleC5H7NO
   950 1-Methyl-2-pyrrolidinoneC5H9NO
   951 2-Ethyl-4,5-dihydro-oxazoleC5H9NO


DHf: -66.7 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
Butanamide
 H=-66.7 HR=NIST
  O     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.21231874  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.50933151  1  124.7226817  1    0.0000000  0     2     1     0
  C     1.53341511  1  109.7885288  1    0.2631759  1     3     2     1
  C     1.52592864  1  111.0126270  1 -179.9638205  1     4     3     2
  N     1.38751046  1  119.0248021  1 -179.9809897  1     2     1     3
  H     1.10846450  1  110.2973097  1 -121.5641042  1     3     2     4
  H     1.10854670  1  110.3153417  1 -116.9224010  1     3     2     7
  H     1.10919008  1  109.8165979  1  122.6456823  1     4     3     5
  H     1.10914774  1  109.8360995  1  114.7282966  1     4     3     9
  H     1.09549416  1  111.7282827  1  -60.2655773  1     5     4     3
  H     1.09551833  1  111.7104506  1  120.7371351  1     5     4    11
  H     1.09700560  1  110.9305005  1  119.6142714  1     5     4    12
  H     0.99170356  1  123.3998848  1 -179.9999679  1     6     2     1
  H     1.00021307  1  119.6262859  1 -179.9995813  1     6     2    14