Accuracy

2-methyl-4-hydroxyquinoline    991 2-Methyl-4-hydroxyquinoline

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    #  Species Formula
   981 2(1H)-QuinolinoneC9H7NO
   982 3-Phenyl isoxazoleC9H7NO
   983 4-QuinolinolC9H7NO
   984 5-Phenyl isoxazoleC9H7NO
   985 8-QuinolinolC9H7NO
   986 a-CyanoacetophenoneC9H7NO
   987 2,4,6-TrimethylnitrosobenzeneC9H11NO
   988 N,N-Dimethyl benzamideC9H11NO
   989 N,N-Dimethyamino-2,4,6-heptatriene-7-alC9H13NO
   990 2,2,6,6-Tetramethyl-4-piperidinoneC9H17NO
   991 2-Methyl-4-hydroxyquinoline C10H9NO
   992 2-Methyl-8-quinolinolC10H9NO
   993 3-Methyl-5-phenyl isoxazoleC10H9NO
   994 4-Methyl-2-hydroxyquinolineC10H9NO
   995 5-Methyl-3-phenyl isoxazoleC10H9NO
   996 beta-CyanopropiophenoneC10H9NO
   997 2,4,6-Trimethylbenzonitrile, N-oxideC10H11NO
   998 2-(Dimethylamino)-acetophenoneC10H13NO
   999 N,N,4-Trimethyl benzamideC10H13NO
  1000 (E)-3-(Methylamino)-1-phenyl-but-2-enoneC11H13NO
  1001 1-Propanone, 2-(dimethylamino)-1-phenyl-C11H15NO


ΔHf: -5.6 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-Methyl-4-hydroxyquinoline
 H=-5.6 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.37291332 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.41731813 +1  120.3810601 +1    0.0000000 +0     2     1     0
  C     1.37136425 +1  120.9752768 +1   -0.0107289 +1     3     2     1
  C     1.42417178 +1  119.6733119 +1   -0.0087130 +1     4     3     2
  C     1.41850001 +1  119.1779097 +1    0.0035976 +1     5     4     3
  C     1.42703459 +1  116.3077035 +1 -179.9952092 +1     6     5     4
  C     1.37492178 +1  121.5877838 +1   -0.0029674 +1     7     6     5
  C     1.42749912 +1  117.5285181 +1   -0.0139107 +1     8     7     6
  N     1.32624207 +1  123.0515573 +1    0.0040604 +1     9     8     7
  C     1.49328587 +1  119.5250717 +1  179.9789282 +1     9     8    10
  O     1.35043206 +1  114.8718540 +1  179.9951944 +1     7     6     8
  H     1.09159224 +1  121.4145229 +1 -179.9902679 +1     1     2     3
  H     1.08785914 +1  120.7294421 +1  179.9937092 +1     2     1     3
  H     1.09040099 +1  118.6301401 +1  179.9999559 +1     3     2     4
  H     1.09013953 +1  122.1812647 +1 -179.9942086 +1     4     3     5
  H     1.08067721 +1  122.7288921 +1 -179.9949907 +1     8     7     9
  H     1.09927508 +1  111.2465725 +1  -59.8076969 +1    11     9     8
  H     1.09936068 +1  111.2263603 +1  120.4211211 +1    11     9    18
  H     1.10393433 +1  111.7258519 +1  119.7709736 +1    11     9    19
  H     0.99190968 +1  112.3172265 +1 -179.9956046 +1    12     7     6