PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
silicon tetrachloride
2623 Silicon tetrachloride
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ΔHf: -158.4 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).
I.P.: 11.8 eV, REF: J. C. Green, M. L. H. Green, P. J. Joachim, A. F. Orchard, D. W. Turner, Philos. Trans. R. Soc. London, Ser. A, 111, A268 (1970).
ITRY=900 PM7
Silicon tetrachloride
H=-158.4,0.31 HR=JANAF86 I=11.79 IR=GGJO1970 S=79.04 CP=21.58
Cl 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Si 2.00054471 +1 0.0000000 +0 0.0000000 +0 1 0 0
Cl 2.00056440 +1 109.4712210 +0 0.0000000 +0 2 1 0
Cl 2.00052789 +1 109.4712210 +0 -120.0000000 +0 2 1 3
Cl 2.00055453 +1 109.4712210 +0 120.0000000 +0 2 1 3