Accuracy

tabr4r   7332 Tantalum(V) tetrabromide, cation (Geo)

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    #  Species Formula
  7322 Tantalum(V) tetrachloride, cationCl4Ta
  7323 Ta(IV)Cl4N2 (LATVUX) (Geo)C10H10N2Cl4Ta
  7324 Ta(IV)Cl4N2 (LATVUX)C10H10N2Cl4Ta
  7325 Tantalum pentachloride (Geo)Cl5Ta
  7326 Tantalum(V) pentachlorideCl5Ta
  7327 Ta(V)Cl6(-) (EMUCOE) (Geo)Cl6Ta
  7328 Tantalum(III) tribromide (Geo)Br3Ta
  7329 Tantalum(III) tribromideBr3Ta
  7330 Tantalum(V) oxide tribromideOBr3Ta
  7331 Tantalum(V) oxide tribromide (Geo)OBr3Ta
  7332 Tantalum(V) tetrabromide, cation (Geo) Br4Ta
  7333 Tantalum(V) tetrabromide, cationBr4Ta
  7334 Tantalum(III) triiodide (Geo)I3Ta
  7335 Tantalum(III) triiodideI3Ta
  7336 Tantalum(V) oxide triiodideOI3Ta
  7337 Tantalum(V) oxide triiodide (Geo)OI3Ta
  7338 Tantalum(V) tetraiodide, cation (Geo)I4Ta
  7339 Tantalum(V) tetraiodide, cationI4Ta
  7340 Ta6Cl12, dicationCl12Ta6
  7341 Ta6Br12, dicationBr12Ta6
  7342 Tungsten, cationW


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 PM7
Tantalum(V) tetrabromide, cation
 <Ta-Br> GR=PW91D
 Br     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Ta     2.34800000 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Br     2.47326131 +1  106.7744459 +1    0.0000000 +0     2     1     0
 Br     2.47324796 +1  106.7623129 +1 -119.9349961 +1     2     1     3
 Br     2.47314926 +1  106.7554109 +1 -119.9220882 +1     2     1     4