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

copper(ii) tribromide, anion   4372 Copper(II) tribromide, anion

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    #  Species Formula
  4362 Phosphorus thiobromidePSBr3
  4363 Phosphorus thiotribromide (Geo)PSBr3
  4364 Scandium tribromideScBr3
  4365 Scandium(III) tribromide (Geo)ScBr3
  4366 Titanium tribromideTiBr3
  4367 Vanadium(III) tribromideVBr3
  4368 Vanadium(III) tribromide (Geo)VBr3
  4369 Cr(III)Br3N3 (MAMLER)C6H15N3CrBr3
  4370 Cr(III)Br3N3(0) (MAMLER) (Geo)C6H15N3CrBr3
  4371 Mn(CO)4CBr (Al) (CMNCXA10) (Geo)C6H3O5AlMnBr3
  4372 Copper(II) tribromide, anion CuBr3
  4373 Copper(II) tribromide, anion (Geo)CuBr3
  4374 Gallium tribromideGaBr3
  4375 Gallium tribromide-ammonia (Geo)H3NGaBr3
  4376 Tribromomethylgermane (Geo)CH3GeBr3
  4377 TribromovinylgermaneC2H3GeBr3
  4378 Arsenic tribromideAsBr3
  4379 Arsenic tribromide (Geo)AsBr3
  4380 As(III)CBr2 (FAFWAK) (Geo)C6H4AsBr3
  4381 As(III)CBr2 (FAFWAK)C6H4AsBr3
  4382 Carbon tetrabromide (Geo)CBr4


ΔHf: -109.4 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.
I.P.: 2.0 eV,     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 UHF RELSCF=50 PM7
Copper(II) tribromide, anion
 H=-109.4 HR=PW91D I=2.01 IR=PW91D
 Cu     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Br     2.55069919 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Br     2.55057850 +1   64.1842871 +1    0.0000000 +0     1     2     0
 Br     2.42314709 +1  142.3565079 +1 -179.0670215 +1     1     2     3