Accuracy

bicyclo(2.2.1)heptan-7-ol    794 Bicyclo[2.2.1]heptan-7-ol

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    #  Species Formula
   784 BenzaldehydeC7H6O
   785 AnisoleC7H8O
   786 m-CresolC7H8O
   787 o-CresolC7H8O
   788 p-CresolC7H8O
   789 2-Methyl-5-hexen-3-yn-2-olC7H10O
   790 2-NorbornanoneC7H10O
   791 cis-2,3-Epoxybicyclo[2.2.1]heptaneC7H10O
   792 Norbornan-7-oneC7H10O
   793 1-Methoxy cyclohexeneC7H12O
   794 Bicyclo[2.2.1]heptan-7-ol C7H12O
   795 cis-1,2-EpoxycycloheptaneC7H12O
   796 CycloheptanoneC7H12O
   797 2,4-Dimethyl 3-pentanoneC7H14O
   798 2-Methyl cis-cyclohexanolC7H14O
   799 3,3-Dimethyl-2-pentanoneC7H14O
   800 4-HeptanoneC7H14O
   801 HeptanalC7H14O
   802 t-Butyl ethyl ketoneC7H14O
   803 n-HeptanolC7H16O
   804 t-Butyl isopropyl etherC7H16O


ΔHf: -52.0 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.
  
 PM7
Bicyclo[2.2.1]heptan-7-ol
 H=-52.0 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.54995000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.55806603 +1  103.6874185 +1    0.0000000 +0     2     1     0
  C     1.54987460 +1  103.6425722 +1    0.1235739 +1     3     2     1
  C     1.54835418 +1  107.9964798 +1   70.3092545 +1     4     3     2
  C     1.54854173 +1  107.9314505 +1  -70.4813554 +1     1     2     3
  C     1.56227720 +1  100.1136684 +1 -106.3179069 +1     4     3     5
  H     1.09129500 +1  114.7780067 +1 -128.9620207 +1     1     2     6
  H     1.09899279 +1  111.3638003 +1 -119.9849493 +1     2     1     3
  H     1.09780306 +1  111.8600425 +1 -119.3405750 +1     2     1     9
  H     1.09133943 +1  114.7743292 +1 -124.6654165 +1     4     3     7
  H     1.09897665 +1  111.4594011 +1  168.9902655 +1     5     4     3
  H     1.09867612 +1  111.7401041 +1 -118.9248671 +1     5     4    12
  H     1.09894670 +1  111.4687382 +1 -169.0429449 +1     6     1     2
  H     1.09866167 +1  111.7278093 +1  118.8988038 +1     6     1    14
  O     1.39207596 +1  114.9805501 +1  177.2092642 +1     7     4     3
  H     1.09896382 +1  111.5010692 +1 -119.8883470 +1     3     2     4
  H     1.09780716 +1  111.8235901 +1 -119.4371846 +1     3     2    17
  H     0.97751625 +1  112.2184787 +1  -54.4401754 +1    16     7     4
  H     1.10278889 +1  115.1356997 +1  119.2278024 +1     7     4    16