PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
1-bromo-1-chloroethane
4184 1-Bromo-1-chloroethane
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ΔHf: -19.4 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-Bromo-1-chloroethane
H=-19.4 HR=NIST
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.50067765 +1 0.0000000 +0 0.0000000 +0 1 0 0
Cl 1.77557832 +1 109.0062765 +1 0.0000000 +0 2 1 0
Br 1.96656154 +1 110.7175728 +1 120.6549198 +1 2 1 3
H 1.10287007 +1 113.1199026 +1 -58.8676119 +1 1 2 3
H 1.10183492 +1 112.3241921 +1 -179.6150853 +1 1 2 3
H 1.10317184 +1 111.6397887 +1 60.9430295 +1 1 2 3
H 1.10704035 +1 114.4167777 +1 -178.0182475 +1 2 1 5