PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
n-methylcarbazole
581 N-Methylcarbazole
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ΔHf: 47.6 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
N-Methylcarbazole
H=47.6 HR=NIST
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.39066330 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.40305660 +1 121.1225386 +1 0.0000000 +0 2 1 0
C 1.38897099 +1 121.6507076 +1 0.0727256 +1 3 2 1
C 1.39620637 +1 117.3699182 +1 0.0652535 +1 4 3 2
C 1.38897156 +1 118.7126773 +1 0.0120586 +1 1 2 3
N 1.40031383 +1 129.7433288 +1 178.0536495 +1 5 4 3
C 1.39986070 +1 108.6653406 +1 178.3905517 +1 7 5 4
C 1.43473277 +1 108.7487637 +1 3.1903569 +1 8 7 5
C 1.38890857 +1 119.7508034 +1 177.8033969 +1 9 8 7
C 1.39071223 +1 118.7003384 +1 0.2843589 +1 10 9 8
C 1.40282942 +1 121.1080319 +1 -0.0131767 +1 11 10 9
C 1.39628193 +1 129.8721818 +1 178.0199421 +1 8 7 9
H 1.08785206 +1 121.0525341 +1 179.9742525 +1 1 2 6
H 1.08723004 +1 119.7064623 +1 -179.9761246 +1 2 1 3
H 1.08973907 +1 119.0071768 +1 -179.9666294 +1 3 2 4
H 1.08329592 +1 121.3107633 +1 179.9907534 +1 4 3 5
H 1.08792354 +1 120.2141582 +1 -179.9971185 +1 10 9 11
H 1.08713695 +1 119.7133235 +1 179.9883462 +1 11 10 12
H 1.08981466 +1 119.0079110 +1 179.8466317 +1 12 11 10
H 1.08327752 +1 121.3873926 +1 2.6014834 +1 13 8 7
C 1.44933784 +1 124.6832713 +1 -168.1085406 +1 7 5 8
H 1.10697287 +1 111.3825426 +1 74.8483626 +1 22 7 5
H 1.10553418 +1 110.6120454 +1 120.5692755 +1 22 7 23
H 1.10680446 +1 110.2642786 +1 119.0213886 +1 22 7 24