Accuracy
(hg(ii)cl4)(=)
7940 [Hg(II)Cl4](=)
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Geometry predicted using PM7
ΔHf: -144.8 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 PM7
[Hg(II)Cl4](=)
H=-144.8 HR=PW91D
Hg 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Cl 2.42473950 +1 0.0000000 +0 0.0000000 +0 1 0 0
Cl 2.42488659 +1 109.4350987 +1 0.0000000 +0 1 2 0
Cl 2.42409476 +1 109.4832215 +1 119.9613245 +1 1 2 3
Cl 2.42407632 +1 109.4953394 +1 120.0122594 +1 1 2 4