PM7 Accuracy

2-methyl propanamide    940 2-Methyl propanamide

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    #  Species Formula
   930 MethoxyacetonitrileC3H5NO
   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 propanamide C4H9NO
   941 ButanamideC4H9NO
   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


DHf: -67.5 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
2-Methyl propanamide
 H=-67.5 HR=NIST
  C     0.00000000  0    0.0000000  0    0.0000000  0     0     0     0
  C     1.53019486  1    0.0000000  0    0.0000000  0     1     0     0
  C     1.52936337  1  111.3270509  1    0.0000000  0     2     1     0
  C     1.52187757  1  107.7183936  1  118.0601573  1     2     1     3
  O     1.21236474  1  124.0208382  1  -60.0489453  1     4     2     1
  N     1.38662434  1  116.9529945  1  179.5869666  1     4     2     5
  H     1.10053428  1  111.0552544  1  -60.7983694  1     1     2     3
  H     1.09586350  1  111.7791575  1 -119.6484675  1     1     2     7
  H     1.09539778  1  111.3386227  1 -120.6272754  1     1     2     8
  H     1.11565945  1  109.1103709  1  121.1753610  1     2     1     4
  H     1.09569724  1  111.8242632  1 -177.4106863  1     3     2     1
  H     1.10071710  1  111.0585825  1 -119.7672077  1     3     2    11
  H     1.09561636  1  111.3303933  1 -119.6388413  1     3     2    12
  H     0.99180850  1  123.4038152  1    2.4283166  1     6     4     2
  H     1.00015769  1  119.6846040  1  176.9764624  1     6     4    14