Accuracy

benzylamine    414 Benzylamine

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    #  Species Formula
   404 2,5-Dimethyl-1H-pyrroleC6H9N
   405 2-MethylpiperidineC6H13N
   406 CyclohexamethylenimineC6H13N
   407 CyclohexanamineC6H13N
   408 Di-n-propylamineC6H15N
   409 DiiospropylamineC6H15N
   410 TriethylamineC6H15N
   411 Phenyl cyanideC7H5N
   412 1-CyclohexenecarbonitrileC7H9N
   413 2-CyclohexenecarbonitrileC7H9N
   414 Benzylamine C7H9N
   415 2,6-DimethylpyridineC7H9N
   416 m-ToluidineC7H9N
   417 N-MethylanilineC7H9N
   418 o-ToluidineC7H9N
   419 p-ToluidineC7H9N
   420 CyclohexanecarbonitrileC7H11N
   421 Hexahydro-1H-pyrrolizineC7H13N
   422 n-HeptanenitrileC7H13N
   423 IsopropylbutylamineC7H17N
   424 1-NorbornylcyanideC8H11N


ΔHf: 21.0 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.
  

Benzylamine
 H=20.98 HR=NIST
  C     0.00040616 +1   0.00206634 +1   0.00182880 +1
  C    -1.09919730 +1  -0.82106032 +1  -0.24538656 +1
  C    -1.00155640 +1  -2.19529048 +1  -0.03895220 +1
  C     0.19388555 +1  -2.75025528 +1   0.41500631 +1
  C     1.29272837 +1  -1.92888736 +1   0.66094341 +1
  C     1.19703849 +1  -0.55410677 +1   0.45488247 +1
  C    -0.11356732 +1   1.49225900 +1  -0.19943854 +1
  N    -0.61424390 +1   2.19743815 +1   0.99835605 +1
  H    -2.03286842 +1  -0.39148813 +1  -0.60267202 +1
  H    -1.85909925 +1  -2.83621358 +1  -0.23383430 +1
  H     0.26994101 +1  -3.82436726 +1   0.57475673 +1
  H     2.22741018 +1  -2.36161936 +1   1.01302145 +1
  H     2.05811319 +1   0.08323431 +1   0.64452134 +1
  H     0.87041284 +1   1.93722066 +1  -0.47451641 +1
  H    -0.79513417 +1   1.72973057 +1  -1.04899788 +1
  H    -1.53356371 +1   1.87687008 +1   1.25861712 +1
  H     0.00067106 +1   2.06911188 +1   1.78645043 +1