Accuracy

9,10-phenanthroquinone   1039 9,10-Phenanthroquinone

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    #  Species Formula
  1029 Oxacyclododecan-2-oneC11H20O2
  1030 Ethyl nonanoateC11H22O2
  1031 1,1-DibutoxypropaneC11H24O2
  1032 Pentamethylbenzoic acidC12H16O2
  1033 5,5-Dimethyl-2-phenyl-1,3-dioxaneC12H16O2
  1034 2,2,6,6-Tetramethyl-3,5-heptanedioneC12H22O2
  1035 Ethyl decanoateC12H24O2
  1036 XanthoneC13H8O2
  1037 Phenyl benzoateC13H10O2
  1038 9,10-AnthroquinoneC14H8O2
  1039 9,10-Phenanthroquinone C14H8O2
  1040 Nitrogen dioxideNO2
  1041 Nitrogen dioxide (Geo)NO2
  1042 Nitrous acid (cis)(https://aip.scitation.org/doi/10.1063/1.1696387) (Geo)HNO2
  1043 Nitrous acid (trans) (https://aip.scitation.org/doi/10.1063/1.1696387) (Geo)HNO2
  1044 Nitrous acid, cisHNO2
  1045 Nitrous acid, transHNO2
  1046 Methyl nitriteCH3NO2
  1047 NitromethaneCH3NO2
  1048 Ethyl nitriteC2H5NO2
  1049 GlycineC2H5NO2


ΔHf: -11.1 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.
  

9,10-Phenanthroquinone
 H=-11.1 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.46876338 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.40495640 +1  119.7522440 +1    0.0000000 +0     2     1     0
  C     1.47542455 +1  119.8403058 +1    1.6197902 +1     3     2     1
  C     1.52603552 +1  114.1903739 +1   26.8407952 +1     4     3     2
  C     1.40490521 +1  119.7403974 +1  -17.4136472 +1     1     2     3
  C     1.39240998 +1  120.9646159 +1 -177.9355299 +1     6     1     2
  C     1.39647896 +1  121.6651952 +1  162.4973439 +1     1     2     3
  C     1.39398250 +1  119.8154221 +1   -1.5843487 +1     7     6     1
  C     1.39497600 +1  120.4337802 +1  178.8448934 +1     8     1     2
  C     1.39229664 +1  120.9997463 +1 -178.4402553 +1     3     2     1
  C     1.39654011 +1  121.6605901 +1  162.1207118 +1     2     1     6
  C     1.39498580 +1  120.4292587 +1  179.3226016 +1    12     2     1
  C     1.39412734 +1  119.7774228 +1   -1.5197292 +1    11     3     2
  O     1.20147224 +1  124.2061919 +1 -152.4421589 +1     4     3     2
  O     1.20134929 +1  121.6113423 +1  139.4821926 +1     5     4     3
  H     1.09333197 +1  119.6744716 +1  178.5057286 +1     7     6     1
  H     1.08909258 +1  120.3652806 +1   -1.6347198 +1     8     1     2
  H     1.08839404 +1  120.0548987 +1 -179.7231435 +1     9     7     6
  H     1.08983432 +1  119.5819521 +1  179.8752097 +1    10     8     1
  H     1.09319470 +1  119.7161115 +1  178.5616804 +1    11     3     2
  H     1.08908608 +1  120.3746666 +1   -1.1248871 +1    12     2     1
  H     1.08989646 +1  119.5625176 +1  179.8669212 +1    13    12     2
  H     1.08839585 +1  120.0483462 +1 -179.7198087 +1    14    11     3