Accuracy

dibutylamine    540 Dibutylamine

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    #  Species Formula
   530 1-NorbornylcyanideC8H11N
   531 1-NorbornylisocyanideC8H11N
   532 5-Ethyl-2-methyl-pyridineC8H11N
   533 N,N-Dimethyl anilineC8H11N
   534 N-Ethyl anilineC8H11N
   535 3-Azabicyclo[3.2.2]nonaneC8H15N
   536 n-Heptyl cyanideC8H15N
   537 N-(2-Methylpropylidene)-butylamineC8H17N
   538 2-Methyl-N-(2-methylpropyl)-1-propanamineC8H19N
   539 Di-sec-butylamineC8H19N
   540 Dibutylamine C8H19N
   541 N-(2-Methylpropyl)-1-butanamineC8H19N
   542 n-OctylamineC8H19N
   543 IsoquinolineC9H7N
   544 QuinolineC9H7N
   545 2,6-DimethylbenzonitrileC9H9N
   546 (1a,2a,4a)-Bicyclo[2.2.2]oct-5-ene-2-carbonitrileC9H11N
   547 (1a,2b,4a)-Bicyclo[2.2.2]oct-5-ene-2-carbonitrileC9H11N
   548 1,2,3,4-TetrahydroquinolineC9H11N
   549 5,6,7,8-TetrahydroquinolineC9H11N
   550 N,N-Dimethyl m-toluidineC9H13N


ΔHf: -40.9 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
Dibutylamine
 H=-40.89 HR=NIST
  C     0.00619804 +1  -0.07225592 +1  -0.00851534 +1
  C     1.32577700 +1   0.69907987 +1  -0.04522818 +1
  C     2.16468107 +1   0.40100213 +1   1.20222143 +1
  C     3.48662123 +1   1.18742369 +1   1.16478635 +1
  N     4.31914927 +1   0.77662241 +1   2.32006706 +1
  C     5.57364097 +1   1.56224391 +1   2.39124037 +1
  C     6.34545364 +1   1.14868937 +1   3.65640892 +1
  C     7.70689483 +1   1.85034298 +1   3.70812770 +1
  C     8.47503103 +1   1.44753779 +1   4.96697422 +1
  H     0.17592669 +1  -1.15388614 +1   0.04377598 +1
  H    -0.59901637 +1   0.20827309 +1   0.86061159 +1
  H    -0.59309850 +1   0.12376460 +1  -0.90451547 +1
  H     1.89361449 +1   0.42987775 +1  -0.95664618 +1
  H     1.12537826 +1   1.78450405 +1  -0.12068603 +1
  H     1.59432801 +1   0.64967160 +1   2.11505294 +1
  H     2.38401894 +1  -0.68322920 +1   1.26903691 +1
  H     4.05065616 +1   0.94144359 +1   0.23748987 +1
  H     3.28484072 +1   2.27937849 +1   1.14319064 +1
  H     3.79481040 +1   0.85133681 +1   3.18937873 +1
  H     6.17282801 +1   1.32457600 +1   1.48421949 +1
  H     5.39964897 +1   2.65892094 +1   2.38781949 +1
  H     5.75722322 +1   1.38578083 +1   4.56108190 +1
  H     6.47791074 +1   0.04844174 +1   3.66327711 +1
  H     8.29888307 +1   1.59584325 +1   2.80824506 +1
  H     7.57249196 +1   2.94833737 +1   3.68320280 +1
  H     7.92798565 +1   1.72194566 +1   5.87569706 +1
  H     8.64727444 +1   0.36554354 +1   5.00078237 +1
  H     9.45336271 +1   1.93857268 +1   5.01005398 +1