PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
trimethyltin hydride
5499 Trimethyltin hydride
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ΔHf: 5.0 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).
Dipole: 0.7 Debye, REF: R. Gupta, B. Majee, J. Organomet. Chem., 33, 169 (1971).
PULAY PM7
Trimethyltin hydride
H=5.0 HR=WEPS1982 D=0.67 DR=GM1971
H 0.00000000 +0 0.00000000 +0 0.00000000 +0
Sn 1.70825682 +1 0.00000000 +0 0.00000000 +0
C 2.43354117 +1 2.00593352 +1 0.00000000 +0
C 2.42837191 +0 -1.00262740 +0 1.74803897 +1
C 2.42837191 +0 -1.00176450 +0 -1.74743424 +1
H 3.52450387 +0 2.00097830 +0 0.01769915 +1
H 2.10065314 +0 2.53999780 +0 -0.88651257 +1
H 2.07142723 +0 2.55210140 +0 0.86749920 +1
H 3.51610583 +1 -1.00454104 +1 1.77937132 +1
H 2.07520539 +0 -0.51582111 +1 2.65303816 +1
H 2.09653805 +0 -2.03737280 +1 1.77422973 +1
H 3.52464218 +0 -1.01159807 +1 -1.77308137 +1
H 2.08934353 +0 -2.03378445 +1 -1.77934967 +1
H 2.08348113 +0 -0.50965626 +1 -2.65307863 +1