Accuracy

in(iii)c2br2(-) (masmbi) r   5467 In(III)C2Br2(-) (MASMBI) (Geo)

(Previous)     (Back)     (Next)        

   

    #  Species Formula
  5457 Indium trichloride (Geo)Cl3In
  5458 Indium trichlorideCl3In
  5459 In(III)O2Cl3 (VUKKOB) (Geo)H4O2Cl3In
  5460 In(III)Cl6(3-) (FUVCAA) (Geo)Cl6In
  5461 In(III)Cl6(3-) (FUVCAA)Cl6In
  5462 InH3-GaH3, complex (Geo)H6GaIn
  5463 Indium selenideSeIn
  5464 Indium selenide, complex (Geo)SeIn
  5465 Indium bromide (Geo)BrIn
  5466 Indium bromideBrIn
  5467 In(III)C2Br2(-) (MASMBI) (Geo) C2H6Br2In
  5468 In(III)C2Br2(-) (MASMBI)C2H6Br2In
  5469 Indium tribromide (Geo)Br3In
  5470 Indium tribromideBr3In
  5471 In(III)CBr3 (PETNUX) (Geo)C6H14N2SBr3In
  5472 In(III)CBr3 (PETNUX)C6H14N2SBr3In
  5473 In(((I)ClBr3(-) (BUPNAB) (Geo)ClBr3In
  5474 In(((I)ClBr3(-) (BUPNAB)ClBr3In
  5475 Indium, dimerIn2
  5476 In(III)C2N2 (AMDMIN) (Geo)C8H24N2In2
  5477 In(III)C2N2 (AMDMIN)C8H24N2In2


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 CHARGE=-1 PM7
In(III)C2Br2(-) (MASMBI)
 <In-Br> <><Br-In-Br> <In-C><C-In-Br> GR=CCDC
 In     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Br     2.64322500 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Br     2.56079349 +1   98.9581080 +1    0.0000000 +0     1     2     0
  C     2.11208800 +1  103.7079250 +1 -115.8231695 +1     1     2     3
  C     2.18072690 +1  112.5694059 +1 -126.0484409 +1     1     2     4
  H     1.08761047 +1  111.1868596 +1  125.4410469 +1     4     1     2
  H     1.08899357 +1  109.8208844 +1 -119.3414393 +1     4     1     6
  H     1.08636922 +1  111.3434919 +1 -119.8091519 +1     4     1     7
  H     1.08393781 +1  109.9904290 +1 -102.2722962 +1     5     1     2
  H     1.08452444 +1  109.1579033 +1  119.5780157 +1     5     1     9
  H     1.08258373 +1  110.1921701 +1  119.9978343 +1     5     1    10