PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
trimethylborane-trimethylphosphine
1963 Trimethylborane-Trimethylphosphine
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ΔHf: -68.3 kcal/mol, REF: D. D. Wagman, W. H. Evans, V. B. Parker, R. H. Schumm, I. Halow, S. M. Bailey, K. L. Churney, R. L. Nuttall, J. Phys. Chem. Ref. Data Suppl. 11, 2 (1982).
PM7
Trimethylborane-Trimethylphosphine
H=-68.3 HR=WEPS1982
B 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.67917761 +1 0.0000000 +0 0.0000000 +0 1 0 0
H 1.08844003 +1 111.7226906 +1 0.0000000 +0 2 1 0
H 1.09159638 +1 106.4902531 +1 117.8078527 +1 2 1 3
H 1.08802819 +1 112.1545431 +1 118.0722728 +1 2 1 4
C 1.67951817 +1 106.2026236 +1 -59.5629609 +1 1 2 3
H 1.08840638 +1 111.8157164 +1 60.8377142 +1 6 1 2
H 1.08797417 +1 112.1283427 +1 124.0980249 +1 6 1 7
H 1.09159561 +1 106.4211360 +1 118.0626892 +1 6 1 8
C 1.67915706 +1 106.2986282 +1 -112.9227626 +1 1 2 6
H 1.09149230 +1 106.5316825 +1 57.5991061 +1 10 1 2
H 1.08811266 +1 112.1600918 +1 118.1246062 +1 10 1 11
H 1.08850243 +1 111.6834493 +1 123.9811854 +1 10 1 12
P 2.05438764 +1 112.5267925 +1 -123.5236784 +1 1 2 10
C 1.82699022 +1 110.3830085 +1 -179.3604059 +1 14 1 2
C 1.82656408 +1 110.4509095 +1 119.9863381 +1 14 1 15
C 1.82659669 +1 110.4381095 +1 120.0342502 +1 14 1 16
H 1.12265458 +1 110.9234106 +1 58.5169646 +1 15 14 1
H 1.11332412 +1 114.0055096 +1 121.5792508 +1 15 14 18
H 1.12264751 +1 110.9171054 +1 121.5522696 +1 15 14 19
H 1.12277994 +1 110.9270096 +1 58.2741283 +1 16 14 1
H 1.11343130 +1 114.0071502 +1 121.5490259 +1 16 14 21
H 1.12271919 +1 110.9387806 +1 121.5697898 +1 16 14 22
H 1.12271618 +1 110.9308746 +1 58.3365184 +1 17 14 1
H 1.11341405 +1 114.0212965 +1 121.5556309 +1 17 14 24
H 1.12268434 +1 110.9447622 +1 121.5600179 +1 17 14 25