PM7 Accuracy

n-ethyl aniline    536 N-Ethyl aniline

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    #  Species Formula
   526 p-ToluidineC7H9N
   527 CyanocyclohexaneC7H11N
   528 CyclohexanecarbonitrileC7H11N
   529 Hexahydro-1H-pyrrolizineC7H13N
   530 n-HeptanenitrileC7H13N
   531 IsopropylbutylamineC7H17N
   532 1-NorbornylcyanideC8H11N
   533 1-NorbornylisocyanideC8H11N
   534 5-Ethyl-2-methyl-pyridineC8H11N
   535 N,N-Dimethyl anilineC8H11N
   536 N-Ethyl aniline C8H11N
   537 3-Azabicyclo[3.2.2]nonaneC8H15N
   538 n-Heptyl cyanideC8H15N
   539 N-(2-Methylpropylidene)-butylamineC8H17N
   540 2-Methyl-N-(2-methylpropyl)-1-propanamineC8H19N
   541 Di-sec-butylamineC8H19N
   542 DibutylamineC8H19N
   543 N-(2-Methylpropyl)-1-butanamineC8H19N
   544 n-OctylamineC8H19N
   545 IsoquinolineC9H7N
   546 QuinolineC9H7N


DHf: 13.4 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-Ethyl aniline
 H=13.4 HR=NIST
  C     0.06766717  1  -0.01599545  1  -0.22923618  1
  C    -0.43384132  1   1.22531527  1   0.20018208  1
  C    -1.75620630  1   1.32814631  1   0.61807001  1
  C    -2.59116486  1   0.21309166  1   0.62442712  1
  C    -2.09647436  1  -1.01847026  1   0.19554722  1
  C    -0.78040899  1  -1.14387492  1  -0.22706037  1
  N     1.35985335  1  -0.16606102  1  -0.75351196  1
  C     2.41004598  1   0.79221086  1  -0.37932626  1
  C     2.83595634  1   0.67698108  1   1.08890006  1
  H     0.19767639  1   2.10694582  1   0.19923720  1
  H    -2.14142983  1   2.29401933  1   0.94481452  1
  H    -3.61948599  1   0.30085804  1   0.95959174  1
  H    -2.74814279  1  -1.89178516  1   0.19406094  1
  H    -0.40820349  1  -2.10604642  1  -0.56314584  1
  H     1.69380737  1  -1.12270036  1  -0.80964382  1
  H     3.28104181  1   0.60962481  1  -1.05102648  1
  H     2.05884881  1   1.82461966  1  -0.60517877  1
  H     1.98510867  1   0.83899007  1   1.76351618  1
  H     3.24872165  1  -0.31140285  1   1.31614840  1
  H     3.59927207  1   1.42082735  1   1.34045369  1