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

v(v)br4r   4390 vanadium(V) tetrabromide (Geo)

(Previous)     (Back)     (Next)        

   

    #  Species Formula
  4380 As(III)CBr2 (FAFWAK) (Geo)C6H4AsBr3
  4381 As(III)CBr2 (FAFWAK)C6H4AsBr3
  4382 Carbon tetrabromide (Geo)CBr4
  4383 Tetrabromoethylene (Geo)C2Br4
  4384 Magnesium dibromide, dimerMg2Br4
  4385 Al(III)Br2N2 (BRMAAL) (Geo)C4H12N2Al2Br4
  4386 Al(III)Br2N2 (BRMAAL)C4H12N2Al2Br4
  4387 Silicon tetrabromide (Geo)SiBr4
  4388 Silicon tetrabromideSiBr4
  4389 Titanium tetrabromideTiBr4
  4390 vanadium(V) tetrabromide (Geo) VBr4
  4391 vanadium(V) tetrabromideVBr4
  4392 Vanadium(IV) bromideVBr4
  4393 Vanadium(IV) bromide (Geo)VBr4
  4394 V(V)Br4O(-) (BEVXIJ) (Geo)OVBr4
  4395 V(V)Br4O(-) (BEVXIJ)OVBr4
  4396 V2Br4V2Br4
  4397 V2Br4 (Geo)V2Br4
  4398 Cr(II)Br4O2(2-) (CAGCIW) (Geo)C4H8O4CrBr4
  4399 Cr(II)Br4O2(2-) (CAGCIW)C4H8O4CrBr4
  4400 Mn(II)Br4 (=) (PYDMNB) (Geo)MnBr4


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=1 SHIFT=80 PM7
vanadium(V) tetrabromide
 <V-Br> GR=PW91D
  V     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Br     2.24189300 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Br     2.28222517 +1  109.4832187 +1    0.0000000 +0     1     2     0
 Br     2.28225183 +1  109.4397852 +1  120.0167533 +1     1     2     3
 Br     2.28224150 +1  109.4688567 +1  119.9994396 +1     1     2     4