Accuracy
ch3-cd-clr
5377 Methyl cadmium chloride (Geo)
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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.
PM7
Methyl cadmium chloride
<Cd-Cl> <Cd-C> GR=PW91D
Cd 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
Cl 2.36761000 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 2.15953100 +1 180.0041115 +1 0.0000000 +0 1 2 0
H 1.08828063 +1 104.3788323 +1 -61.5833415 +1 3 1 2
H 1.08831907 +1 104.3749446 +1 119.9963231 +1 3 1 4
H 1.08833163 +1 104.3708658 +1 119.9961435 +1 3 1 5