Accuracy

ni(ii)br4r   4404 Nickel(II) tetrabromide D4h (Geo)

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    #  Species Formula
  4394 V2Br4V2Br4
  4395 V2Br4 (Geo)V2Br4
  4396 Cr(II)Br4O2(2-) (CAGCIW) (Geo)C4H8O4CrBr4
  4397 Cr(II)Br4O2(2-) (CAGCIW)C4H8O4CrBr4
  4398 Mn(II)Br4 (=) (PYDMNB) (Geo)MnBr4
  4399 Fe(III)Br4(-) (EPYMBF) (Geo)FeBr4
  4400 Fe(III)Br4(-) (EPYMBF)FeBr4
  4401 Iron dibromide, dimerFe2Br4
  4402 Co(II)Br4(2-) (BPYRBC10) (Geo)CoBr4
  4403 Cobalt(II) tetrabromide (Geo)CoBr4
  4404 Nickel(II) tetrabromide D4h (Geo) NiBr4
  4405 Nickel(II) tetrabromide D4hNiBr4
  4406 Cu(II)Br4(2-) (AHUVUU) (Geo)CuBr4
  4407 Cu(II)Br4(2-) (AHUVUU)CuBr4
  4408 Copper(II) tetrabromide, dianion (Geo)CuBr4
  4409 Cu(I)2Br4(2-) (CEYWAE) (Geo)Cu2Br4
  4410 Cu(I)2Br4(2-) (CEYWAE)Cu2Br4
  4411 Cu(II)2N2Br4 (BPYRCU) (Geo)C10H10N2Cu2Br4
  4412 Cu(II)2N2Br4 (BPYRCU)C10H10N2Cu2Br4
  4413 Cu(II)2N4Br4 (BGLXCU) (Geo)C8H16N4O4Cu2Br4
  4414 Zn(II)Br4(2-) (BEYNUO) (Geo)ZnBr4


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 OPEN(8,5) SHIFT=80 SYMMETRY PM7
Nickel(II) tetrabromide D4h
 <Ni-Br> GR=PW91D
 
 Ni     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Br     2.43704600 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Br     2.43704600 +0  180.0000000 +0    0.0000000 +0     1     2     0
 Br     2.43704600 +0   90.0000000 +1    0.0000000 +1     1     2     3
 Br     2.43704600 +0   90.0000000 +1  180.0000000 +1     1     2     4
 
   2  1    3    4    5