PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
1,2,3,4-tetrahydro-n-methylcarbazole
582 1,2,3,4-Tetrahydro-N-methylcarbazole
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ΔHf: 22.3 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
1,2,3,4-Tetrahydro-N-methylcarbazole
H=22.3 HR=NIST
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.38264031 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.41144738 +1 121.3411896 +1 0.0000000 +0 2 1 0
C 1.38183727 +1 121.5699441 +1 0.0268509 +1 3 2 1
C 1.40161523 +1 117.3909802 +1 -0.0087806 +1 4 3 2
C 1.39793236 +1 118.8422355 +1 0.0781498 +1 1 2 3
N 1.39393995 +1 130.5811477 +1 179.2941709 +1 5 4 3
C 1.39703106 +1 108.5629766 +1 179.2927968 +1 7 5 4
C 1.38969860 +1 109.3040150 +1 1.3585392 +1 8 7 5
C 1.47721189 +1 123.3415151 +1 179.5853284 +1 9 8 7
C 1.54158376 +1 109.8985820 +1 -16.5120001 +1 10 9 8
C 1.53678790 +1 111.0365028 +1 46.8928676 +1 11 10 9
C 1.48165221 +1 125.1858792 +1 178.6122554 +1 8 7 9
H 1.08685983 +1 121.4175665 +1 179.9712884 +1 1 2 6
H 1.08709001 +1 119.9759090 +1 179.9970618 +1 2 1 3
H 1.08842324 +1 118.6736275 +1 -179.9660994 +1 3 2 4
H 1.08316676 +1 121.6408907 +1 -179.8997578 +1 4 3 5
H 1.10880609 +1 110.8344508 +1 -121.9109311 +1 10 9 11
H 1.10628915 +1 109.4644266 +1 -121.3048808 +1 11 10 12
H 1.10697250 +1 109.5219921 +1 56.5780717 +1 12 11 10
H 1.11081984 +1 110.1218960 +1 -73.3101017 +1 13 8 7
C 1.44850256 +1 124.8932090 +1 -176.1389095 +1 7 5 8
H 1.10732059 +1 110.8741754 +1 76.0532704 +1 22 7 5
H 1.10409665 +1 111.0633450 +1 120.5889050 +1 22 7 23
H 1.10706991 +1 110.4607602 +1 119.4919359 +1 22 7 24
H 1.11070030 +1 109.9084978 +1 -116.7077948 +1 10 9 18
H 1.10388903 +1 109.9697140 +1 -116.5593403 +1 11 10 19
H 1.10396646 +1 110.2399935 +1 116.8375181 +1 12 11 20
H 1.10798631 +1 111.7039096 +1 117.9076989 +1 13 8 21