PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
acetamide
925 Acetamide
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ΔHf: -57.0 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
Acetamide
H=-56.962 HR=NIST
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.50099702 +1 0.0000000 +0 0.0000000 +0 1 0 0
O 1.21232064 +1 124.2981027 +1 0.0000000 +0 2 1 0
N 1.38647244 +1 119.2551115 +1 -179.9883052 +1 2 3 1
H 0.99224612 +1 123.2553560 +1 179.9818121 +1 4 2 3
H 1.00027440 +1 119.7486612 +1 -0.0011000 +1 4 2 3
H 1.10361222 +1 109.9057940 +1 0.2754641 +1 1 2 3
H 1.09743686 +1 112.1472749 +1 119.2909721 +1 1 2 3
H 1.09750794 +1 112.1177490 +1 -118.7149125 +1 1 2 3