PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
n,n-dimethylamine diborane
468 N,N-Dimethylamine diborane
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ΔHf: -27.9 kcal/mol, REF: J. O. Cox, G. Pilcher, "Thermochemistry of Organic and Organometallic Compounds," Academic Press, New York, N.Y., 1970.
PM7
N,N-Dimethylamine diborane
H=-27.9 HR=C&P1970
B 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
B 1.75699102 +1 0.0000000 +0 0.0000000 +0 1 0 0
N 1.37664209 +1 130.8453296 +1 0.0000000 +0 2 1 0
C 1.45936422 +1 123.6658698 +1 -0.0168769 +1 3 2 1
C 1.46017695 +1 123.6359080 +1 178.0921296 +1 3 2 1
H 1.27040908 +1 61.4620406 +1 -92.2871287 +1 1 2 3
H 1.19818971 +1 130.6666296 +1 -0.1622101 +1 1 2 3
H 1.19856980 +1 133.2796239 +1 179.2601965 +1 1 2 3
H 1.21543136 +1 112.2594110 +1 87.1422175 +1 2 1 6
H 1.10595498 +1 111.3664593 +1 -125.4461212 +1 4 3 2
H 1.10649308 +1 111.1945274 +1 114.0715795 +1 4 3 2
H 1.10666682 +1 112.2828421 +1 -5.7408691 +1 4 3 2
H 1.10573227 +1 111.8288232 +1 4.5663092 +1 5 3 2
H 1.10665783 +1 111.1986700 +1 -115.3479473 +1 5 3 2
H 1.10636541 +1 111.3219806 +1 124.3354704 +1 5 3 2
H 1.27475389 +1 60.4867976 +1 91.5324030 +1 1 2 3