PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
boron triiodide
6133 Boron triiodide
(Previous)
(Back)
(Next)
ΔHf: 17.0 kcal/mol, REF: M. D. Harmony, V. W. Laurie, R. L. Kuczkowsky, R. H. Schwendeman, D. A. Ramsay, F. J. Lovas, W. J. Lafferty, A. G. Maki, J. Phys. Chem. Ref. Data 8, 3 (1979).
SYMMETRY PM7
Boron triiodide
H=17 HR=HLKS1979 S=83.46 CP=16.92
I 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
B 2.11173426 +1 0.0000000 +0 0.0000000 +0 1 0 0
I 2.11173426 +1 120.0000000 +1 0.0000000 +0 2 1 0
I 2.11173426 +1 120.0000000 +1 180.0000000 +1 2 1 3