Accuracy

methyl(1,1,2-trimethylpropyl)malonodinitrile    665 Methyl(1,1,2-trimethylpropyl)malonodinitrile

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    #  Species Formula
   655 6-QuinolinamineC9H8N2
   656 8-QuinolinamineC9H8N2
   657 2-(Diethylamino)-pentanenitrileC9H18N2
   658 2,2-BipyridylC10H8N2
   659 2,4-BipyridylC10H8N2
   660 4,4'-BipyridineC10H8N2
   661 2,3-Dimethyl quinoxalineC10H10N2
   662 alpha N,N-dimethylamino phenylacetonitrileC10H12N2
   663 Ethyl(1,1-dimethylpropyl)malonodinitrileC10H16N2
   664 Meso-2,3-diethyl-2,3-dimethylsuccinodinitrileC10H16N2
   665 Methyl(1,1,2-trimethylpropyl)malonodinitrile C10H16N2
   666 PhenazineC12H8N2
   667 PhenazoneC12H8N2
   668 cis-AzobenzeneC12H10N2
   669 Diphenyl diazeneC12H10N2
   670 4,4'-Dimethyl-2,2'-bipyridineC12H12N2
   671 1,(1-Piperidinyl) cyclohexanecarbonitrileC12H20N2
   672 Li(I)(Cp)N2 (SIJNII) (Geo)H23LiC12N2
   673 Li(I)(Cp)N2 (SIJNII)H23LiC12N2
   674 a-Phenyl-1-piperidineacetonitrileC13H16N2
   675 Li(I)N2C5 (FAGCAR) (Geo)H25LiC14N2


ΔHf: 19.0 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
Methyl(1,1,2-trimethylpropyl)malonodinitrile
 H=18.96 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.53901336 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.46185766 +1  108.7421906 +1    0.0000000 +0     1     2     0
  C     1.46485260 +1  107.6572247 +1 -115.4308996 +1     1     2     3
  C     1.58782220 +1  113.0458284 +1 -120.6674211 +1     1     2     4
  C     1.53254653 +1  108.0762889 +1 -171.4013492 +1     5     1     2
  C     1.53804501 +1  107.6868852 +1 -117.4379205 +1     5     1     6
  C     1.55796340 +1  111.7237013 +1 -119.2762599 +1     5     1     7
  C     1.53141659 +1  113.9599353 +1  -53.7578132 +1     8     5     1
  C     1.53682092 +1  111.3824059 +1 -122.4186145 +1     8     5     9
  N     1.15548889 +1  142.0112682 +1 -179.5598001 +1     4     2     1
  N     1.15580690 +1  142.8836127 +1  177.7440642 +1     3     2     1
  H     1.09793564 +1  111.8355892 +1  -59.0088720 +1     2     1     3
  H     1.09775003 +1  111.4980461 +1 -120.4416043 +1     2     1    13
  H     1.09979299 +1  111.4460434 +1 -119.7935387 +1     2     1    14
  H     1.09683494 +1  112.2453008 +1   70.1081419 +1     6     5     1
  H     1.09681682 +1  112.1046985 +1 -121.1556192 +1     6     5    16
  H     1.09729258 +1  111.2412232 +1 -119.2082437 +1     6     5    17
  H     1.09468022 +1  112.2990880 +1  -57.5010286 +1     7     5     1
  H     1.09732256 +1  112.2260784 +1  121.4147976 +1     7     5    19
  H     1.09751019 +1  111.3264123 +1  118.5273069 +1     7     5    20
  H     1.11948546 +1  107.3296330 +1 -117.5500749 +1     8     5    10
  H     1.09427122 +1  112.7681956 +1   70.1483340 +1     9     8     5
  H     1.09669535 +1  112.0400809 +1 -121.8768177 +1     9     8    23
  H     1.09763982 +1  110.8441720 +1 -119.0072008 +1     9     8    24
  H     1.09435719 +1  112.4409964 +1  -52.2980826 +1    10     8     5
  H     1.09600148 +1  111.6082678 +1  121.2992336 +1    10     8    26
  H     1.09653283 +1  110.6581296 +1  119.1237622 +1    10     8    27