Accuracy

Pd(IV)Cl6(2-) (JIZLOT)   5259 Pd(IV)Cl6(2-) (JIZLOT)

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    #  Species Formula
  5249 trans-Pd(Cl)2(SEt2)2 (Geo)C8H20S2Cl2Pd
  5250 Pd(II)(CO)Cl3(-) (KATPEA) (Geo)COCl3Pd
  5251 Pd(II)(CO)Cl3(-) (KATPEA)COCl3Pd
  5252 Palladium(II) tetrachlorideCl4Pd
  5253 Pd(II)Cl4(2-) (AVUKOR) (Geo)Cl4Pd
  5254 Pd(II)Cl4(2-) (AVUKOR)Cl4Pd
  5255 Palladium(II) tetrachloride (Geo)Cl4Pd
  5256 Pd(IV)N2Cl4 (BOKHAK) (Geo)C10H8N2Cl4Pd
  5257 Pd(IV)N2Cl4 (BOKHAK)C10H8N2Cl4Pd
  5258 Pd(IV)Cl6(2-) (JIZLOT) (Geo)Cl6Pd
  5259 Pd(IV)Cl6(2-) (JIZLOT) Cl6Pd
  5260 Palladium(II) dibromideBr2Pd
  5261 Palladium(II) dibromide (Geo)Br2Pd
  5262 Pd(II)Br2N2 (MACGON) (Geo)C10H9N3Br2Pd
  5263 PdC2Br2 (AMIPER) (Geo)C9H12N4Br2Pd
  5264 PdC2Br2 (AMIPER)C9H12N4Br2Pd
  5265 Pd(II)(CO)Br3(-) (KATPIE) (Geo)COBr3Pd
  5266 Pd(II)(CO)Br3(-) (KATPIE)COBr3Pd
  5267 Palladium tetrabromide (Geo)Br4Pd
  5268 Palladium(II) tetrabromideBr4Pd
  5269 Pd(II)Br4(2-) (FETHOB) (Geo)Br4Pd


ΔHf: -149.9 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 UHF PM7
Pd(IV)Cl6(2-) (JIZLOT)
 H=-149.9 HR=PW91D
 Cl     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     2.99955180 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     3.00934805 +1   89.9930173 +1    0.0000000 +0     2     1     0
 Pd     2.12310079 +1   45.0727240 +1   -0.0265219 +1     2     1     3
 Cl     2.12328941 +1   90.0325077 +1  -90.0163693 +1     4     2     1
 Cl     2.12572796 +1   89.9762252 +1 -179.8650101 +1     4     5     2
 Cl     2.12369506 +1   90.0342808 +1   90.0064366 +1     4     2     1