PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

pdbr2r   5263 Palladium(II) dibromide (Geo)

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    #  Species Formula
  5253 Pd(II)(CO)Cl3(-) (KATPEA)COCl3Pd
  5254 Palladium(II) tetrachlorideCl4Pd
  5255 Pd(II)Cl4(2-) (AVUKOR) (Geo)Cl4Pd
  5256 Pd(II)Cl4(2-) (AVUKOR)Cl4Pd
  5257 Palladium(II) tetrachloride (Geo)Cl4Pd
  5258 Pd(IV)N2Cl4 (BOKHAK) (Geo)C10H8N2Cl4Pd
  5259 Pd(IV)N2Cl4 (BOKHAK)C10H8N2Cl4Pd
  5260 Pd(IV)Cl6(2-) (JIZLOT) (Geo)Cl6Pd
  5261 Pd(IV)Cl6(2-) (JIZLOT)Cl6Pd
  5262 Palladium(II) dibromideBr2Pd
  5263 Palladium(II) dibromide (Geo) Br2Pd
  5264 Pd(II)Br2N2 (MACGON) (Geo)C10H9N3Br2Pd
  5265 PdC2Br2 (AMIPER) (Geo)C9H12N4Br2Pd
  5266 PdC2Br2 (AMIPER)C9H12N4Br2Pd
  5267 Pd(II)(CO)Br3(-) (KATPIE) (Geo)COBr3Pd
  5268 Pd(II)(CO)Br3(-) (KATPIE)COBr3Pd
  5269 Palladium tetrabromide (Geo)Br4Pd
  5270 Palladium(II) tetrabromideBr4Pd
  5271 Pd(II)Br4(2-) (FETHOB) (Geo)Br4Pd
  5272 Pd(II)Br4(2-) (FETHOB)Br4Pd
  5273 Palladium(II) tetrabromide (Geo)Br4Pd


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.
  
 PULAY SHIFT=80 PM7
Palladium(II) dibromide
 <Pd-Br> <> <Br-Pd-Br> GR=PW91D
 Pd     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Br     2.37373800 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Br     2.34086621 +1   94.3707060 +1    0.0000000 +0     1     2     0