PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
aluminum triiodide
6137 Aluminum triiodide
(Previous)
(Back)
(Next)
ΔHf: -46.2 kcal/mol, REF: M. W. Chase, C. A. Davies, J. R. Downey, D. R. Frurip, R. A. McDonald, A. N. Syverud, JANAF Thermochemical Tables, Third Edition, J. Phys. Chem. Ref. Data 14, Suppl. 1 (1985).
SYMMETRY PM7
Aluminum triiodide
H=-46.2 HR=JANAF86
I 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Al 2.42687342 +1 0.0000000 +0 0.0000000 +0 1 0 0
I 2.42687342 +1 120.0000000 +1 0.0000000 +0 2 1 0
I 2.42687342 +1 120.0000000 +1 180.0000000 +1 2 1 3