Accuracy

butanamide    938 Butanamide

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    #  Species Formula
   928 DimethylformamideC3H7NO
   929 N-Methyl acetamideC3H7NO
   930 PropanamideC3H7NO
   931 DimethylaminomethanolC3H9NO
   932 3-Methyl isoxazoleC4H5NO
   933 5-Methyl isoxazoleC4H5NO
   934 2-PyrrolidinoneC4H7NO
   935 4,5-Dihydro-2-methyl oxazoleC4H7NO
   936 MethacrylamideC4H7NO
   937 2-Methyl propanamideC4H9NO
   938 Butanamide C4H9NO
   939 IsobutylamideC4H9NO
   940 N,N-dimethyl acetamideC4H9NO
   941 N,N-Diethyl-hydroxylamineC4H11NO
   942 2-PyridinolC5H5NO
   943 3-PyridinolC5H5NO
   944 4-PyridinolC5H5NO
   945 Pyridine 1 oxideC5H5NO
   946 3,5-Dimethyl isoxazoleC5H7NO
   947 1-Methyl-2-pyrrolidinoneC5H9NO
   948 2-Ethyl-4,5-dihydro-oxazoleC5H9NO


ΔHf: -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