PM7 Accuracy

n,n-dimethyl-tert-butylcarboxamide    976 N,N-Dimethyl-tert-butylcarboxamide

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    #  Species Formula
   966 CaprolactamC6H11NO
   967 Cyclohexanone oximeC6H11NO
   968 N,N-Diethyl acetamideC6H13NO
   969 N,N-DimethylbutyramineC6H13NO
   970 BenzoxazoleC7H5NO
   971 IsocyanatobenzeneC7H5NO
   972 BenzamideC7H7NO
   973 N,N-Dimethylamino-2,4-pentadiene-5-alC7H11NO
   974 2-Methoxy-3,3-dimethylbutanenitrileC7H13NO
   975 N,N-DiethylaminoacetoneC7H15NO
   976 N,N-Dimethyl-tert-butylcarboxamide C7H15NO
   977 alpha-oxo BenzeneacetonitrileC8H5NO
   978 1,3-dimethyl-2-nitroso-benzeneC8H9NO
   979 N-methyl-N-phenyl formamideC8H9NO
   980 Octanone-1-oximeC8H17NO
   981 Octanone-2-oximeC8H17NO
   982 Octanone-3-oximeC8H17NO
   983 Octanone-4-oximeC8H17NO
   984 2(1H)-QuinolinoneC9H7NO
   985 3-Phenyl isoxazoleC9H7NO
   986 4-QuinolinolC9H7NO


DHf: -68.4 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
N,N-Dimethyl-tert-butylcarboxamide
 H=-68.38 HR=NIST
  C     0.00528646  1   0.01746885  1   0.01437243  1
  C     1.53567226  1  -0.03448546  1   0.02941048  1
  C    -0.50840111  1   1.45957375  1  -0.01258341  1
  C    -0.52147100  1  -0.66492727  1   1.28942560  1
  C    -0.55127999  1  -0.78243360  1  -1.17604217  1
  O    -1.25891878  1  -1.75637153  1  -0.97070689  1
  N    -0.29843362  1  -0.45042041  1  -2.48997037  1
  C     0.54249524  1   0.64730429  1  -2.95229805  1
  C    -0.86740488  1  -1.28880360  1  -3.55077917  1
  H     1.90052810  1  -1.05805991  1  -0.12543082  1
  H     1.98511287  1   0.60320653  1  -0.73655922  1
  H     1.92586784  1   0.30580837  1   0.99708718  1
  H    -1.59872166  1   1.48933620  1  -0.13380240  1
  H    -0.06751445  1   2.05078908  1  -0.82018151  1
  H    -0.27062195  1   1.97469907  1   0.92665163  1
  H    -1.61945264  1  -0.68113478  1   1.30594191  1
  H    -0.20199837  1  -1.71462769  1   1.33799508  1
  H    -0.17111012  1  -0.15659525  1   2.19136575  1
  H     0.15428590  1   1.62070551  1  -2.59993150  1
  H     1.58523802  1   0.53189248  1  -2.60512059  1
  H     0.56885178  1   0.68899497  1  -4.05544971  1
  H    -0.07040146  1  -1.75863965  1  -4.14931127  1
  H    -1.48611980  1  -2.10414134  1  -3.12062077  1
  H    -1.51918223  1  -0.69119278  1  -4.20939782  1