Accuracy

2,7-dimethylphenanthrene    364 2,7-Dimethylphenanthrene

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    #  Species Formula
   354 TetradecaneC14H30
   355 4-MethylphenanthreneC15H12
   356 1-MethyldiadamantaneC15H22
   357 3-MethyladamantaneC15H22
   358 4-MethyldiadamantaneC15H22
   359 6-(1,1-dimethylethyl)-2,3-dihydro-1,1-dimethyl-1H-IndeneC15H22
   360 n-NonylcyclohexaneC15H30
   361 PentadecaneC15H32
   362 FluorantheneC16H10
   363 PyreneC16H10
   364 2,7-Dimethylphenanthrene C16H14
   365 4,5,9,10-TetrahydropyreneC16H14
   366 9,10-DimethylphenanthreneC16H14
   367 (2.2)MetaparacyclophaneC16H16
   368 [2.2]MetacyclophaneC16H16
   369 [2.2]ParacyclophaneC16H16
   370 1,2,3,6,7,8-HexahydropyreneC16H18
   371 Tricyclo[8.2.2.2]-hexadecaneC16H28
   372 1-HexadeceneC16H32
   373 DecylcyclohexaneC16H32
   374 n-UndecylcyclopentaneC16H32


ΔHf: 34.2 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
2,7-Dimethylphenanthrene
 H=34.2 HR=NIST
  C     0.01092976 +1  -0.01191351 +1  -0.00019044 +1
  C     1.38785787 +1   0.01680055 +1  -0.00124831 +1
  C     2.07669238 +1   1.24841271 +1  -0.02407459 +1
  C     1.36028926 +1   2.42821160 +1  -0.04576465 +1
  C    -0.05146872 +1   2.41039919 +1  -0.04491141 +1
  C    -0.74242411 +1   1.18377236 +1  -0.02236774 +1
  C    -2.18857652 +1   1.18434495 +1  -0.02196445 +1
  C    -2.87872137 +1   2.41141142 +1  -0.04509573 +1
  C    -2.14253129 +1   3.64658897 +1  -0.06779462 +1
  C    -0.78679237 +1   3.64610140 +1  -0.06793478 +1
  C    -4.29043257 +1   2.43028314 +1  -0.04554890 +1
  C    -5.00751053 +1   1.25094721 +1  -0.02391325 +1
  C    -4.31962466 +1   0.01882493 +1  -0.00055984 +1
  C    -2.94271149 +1  -0.01092565 +1   0.00016434 +1
  H    -0.50557353 +1  -0.97113844 +1   0.01753267 +1
  H     1.95735787 +1  -0.91035889 +1   0.01576228 +1
  C     3.56738746 +1   1.24444748 +1  -0.02510819 +1
  H     1.87434040 +1   3.38653350 +1  -0.06350965 +1
  H    -2.70851685 +1   4.57697443 +1  -0.08514511 +1
  H    -0.22017595 +1   4.57612628 +1  -0.08507280 +1
  H    -4.80390561 +1   3.38891558 +1  -0.06354340 +1
  C    -6.49820313 +1   1.24814998 +1  -0.02445998 +1
  H    -4.88987839 +1  -0.90781647 +1   0.01668757 +1
  H    -2.42691719 +1  -0.97051241 +1   0.01832318 +1
  H     3.99745669 +1   2.25478933 +1  -0.03850391 +1
  H     3.96336494 +1   0.71471209 +1  -0.90396855 +1
  H     3.96489338 +1   0.73776411 +1   0.86694675 +1
  H    -6.92752213 +1   2.25864288 +1  -0.04644050 +1
  H    -6.89574935 +1   0.74941939 +1   0.87187291 +1
  H    -6.89499120 +1   0.71130675 +1  -0.89874883 +1