Accuracy

phenanthridine    578 Phenanthridine

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    #  Species Formula
   568 2-Methyl-6-t-butylanilineC11H17N
   569 n-UndecanenitrileC11H21N
   570 CarbazoleC12H9N
   571 2-BiphenylamineC12H11N
   572 BiphenylamineC12H11N
   573 2-n-Butyl-2-methylhexanenitrileC12H23N
   574 6,7-BenzoquinolineC13H9N
   575 a-BenzoquinolineC13H9N
   576 AcridineC13H9N
   577 Benzo[f]quinolineC13H9N
   578 Phenanthridine C13H9N
   579 N-MethylcarbazoleC13H11N
   580 1,2,3,4-Tetrahydro-N-methylcarbazoleC13H15N
   581 9-Ethyl-9H-carbazoleC14H13N
   582 TetradecanenitrileC14H27N
   583 DioctylamineC16H35N
   584 TriphenylamineC18H15N
   585 TrioctylamineC24H51N
   586 Nitrogen (Geo)N2
   587 NitrogenN2
   588 DiazeneH2N2


ΔHf: 57.5 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
Phenanthridine
 H=57.48 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.41118413 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.38039195 +1  120.4351295 +1    0.0000000 +0     2     1     0
  C     1.40697654 +1  120.5281491 +1   -0.0045588 +1     3     2     1
  C     1.37982758 +1  119.9692540 +1   -0.0012836 +1     4     3     2
  C     1.40782590 +1  118.6732610 +1   -0.0002529 +1     1     2     3
  C     1.44570772 +1  122.9264694 +1  179.9962017 +1     1     2     3
  C     1.41368343 +1  118.1791030 +1  179.9957332 +1     7     1     2
  N     1.39360205 +1  122.3115277 +1   -0.0052741 +1     8     7     1
  C     1.44933074 +1  118.4146218 +1  179.9961783 +1     6     1     2
  C     1.40945775 +1  123.3606070 +1    0.0009641 +1     7     1     2
  C     1.38006220 +1  120.6107199 +1  179.9933851 +1    11     7     1
  C     1.40770789 +1  120.5529467 +1   -0.0030982 +1    12    11     7
  C     1.41485650 +1  120.5016660 +1  179.9967516 +1     8     7     1
  H     1.08922541 +1  119.6146651 +1 -179.9993038 +1     2     1     6
  H     1.08974905 +1  120.2305441 +1  179.9989075 +1     3     2     1
  H     1.08843523 +1  119.4323857 +1 -179.9992325 +1     4     3     2
  H     1.08947488 +1  120.6270780 +1 -179.9998417 +1     5     4     3
  H     1.09889148 +1  119.1711012 +1  179.9951394 +1    10     6     1
  H     1.08951772 +1  119.5396652 +1   -0.0013029 +1    11     7     1
  H     1.08896786 +1  120.2491676 +1 -179.9992312 +1    12    11     7
  H     1.08907220 +1  119.3321625 +1  179.9978138 +1    13    12    11
  H     1.09098026 +1  118.5809842 +1  179.9994059 +1    14     8     7