PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
cd(ii)cl4(=)
5390 Cd(II)Cl4(=)
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ΔHf: -179.6 kcal/mol, REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
CHARGE=-2 PULAY PM7
Cd(II)Cl4(=)
H=-179.6 HR=PW91D
Cd 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Cl 2.39664462 +1 0.0000000 +0 0.0000000 +0 1 0 0
Cl 2.39662419 +1 109.4791906 +1 0.0000000 +0 1 2 0
Cl 2.39660071 +1 109.4627973 +1 119.9873904 +1 1 2 3
Cl 2.39661327 +1 109.4791073 +1 119.9916627 +1 1 2 4