Accuracy

3-quinolinamine    653 3-Quinolinamine

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    #  Species Formula
   643 QuinazolineC8H6N2
   644 QuinoxalineC8H6N2
   645 n-PentylmalonodinitrileC8H12N2
   646 TetramethylbutanedinitrileC8H12N2
   647 TetramethylpyrazineC8H12N2
   648 1,4-Dimethyl-2,3-diaza-bicyclo[2.2.2]oct-2-eneC8H14N2
   649 3,4,5,6-Tetrahydro-3,3,6,6-tetramethylpyridazineC8H16N2
   650 Di-n-butyldiazeneC8H18N2
   651 Di-tert-butyldiazeneC8H18N2
   652 1,2-DibutylhydrazineC8H20N2
   653 3-Quinolinamine C9H8N2
   654 5-QuinolinamineC9H8N2
   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


ΔHf: 49.8 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
3-Quinolinamine
 H=49.81 HR=NIST
  C    -0.00286380 +1  -0.00056559 +1  -0.00264376 +1
  C     1.37907295 +1   0.01739422 +1  -0.00722480 +1
  C     2.05390686 +1   1.29795739 +1   0.00113092 +1
  N     1.40848090 +1   2.43999964 +1   0.00725667 +1
  C     0.03089861 +1   2.43622475 +1   0.00704284 +1
  C    -0.71054173 +1   1.22736160 +1   0.00671087 +1
  C    -2.12895569 +1   1.29405264 +1   0.00848255 +1
  C    -2.76215414 +1   2.51103780 +1   0.00769040 +1
  C    -2.01712784 +1   3.71736828 +1   0.00644611 +1
  C    -0.64667074 +1   3.68827583 +1   0.00676794 +1
  N     2.13501996 +1  -1.14667965 +1   0.05802835 +1
  H    -0.55900725 +1  -0.93225435 +1  -0.00043845 +1
  H    -3.85018798 +1   2.56890065 +1   0.00794276 +1
  H     3.14872721 +1   1.34030623 +1   0.01055059 +1
  H    -0.04672199 +1   4.59960422 +1   0.00636799 +1
  H    -2.55230526 +1   4.66462306 +1   0.00496047 +1
  H     3.09505832 +1  -1.11021367 +1  -0.21340266 +1
  H     1.67901716 +1  -2.01792005 +1  -0.12149094 +1
  H    -2.69575358 +1   0.36542737 +1   0.01052039 +1