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Ir(III)NOCl4(2-) (FURCEA) r   7621 Ir(III)NOCl4(2-) (FURCEA) (Geo)

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    #  Species Formula
  7611 Iridium(III) oxide chlorideOClIr
  7612 Iridium(III) oxide chloride (Geo)OClIr
  7613 Ir(III)N3Cl3 (YAPGOL) (Geo)C6H15N3Cl3Ir
  7614 fac-(1,4,7-Triazacyclononane-trichloro-iridium) (Geo)C6H15N3Cl3Ir
  7615 Iridium En Py Cl3 (Geo)C7H13N3Cl3Ir
  7616 Iridium(V) tetrachloride, cation (Geo)Cl4Ir
  7617 Iridium(V) tetrachloride, cationCl4Ir
  7618 Ir(III)Cl4N2(-) (IMIXUX) (Geo)C2H4N2Cl4Ir
  7619 Ir(III)Cl4N2(-) (IMIXOR) (Geo)C2H8N2Cl4Ir
  7620 Ir(IV)Cl4N2 (GIKBEH) (Geo)C12H8N2Cl4Ir
  7621 Ir(III)NOCl4(2-) (FURCEA) (Geo) C3H6NO2Cl4Ir
  7622 Ir(III)Cl4S2(-) (BOCLUA) (Geo)C4H12S2Cl4Ir
  7623 Ir(III)Cl5N(2-) (CLPZIR) (Geo)C4H4N2Cl5Ir
  7624 Ir(V)Cl6(-) (TEVFIJ) (Geo)Cl6Ir
  7625 Ir(III)Cl6 d6 (Geo)Cl6Ir
  7626 Iridium(III) hexachloride (Geo)Cl6Ir
  7627 Iridium(III) hexachlorideCl6Ir
  7628 Iridium(I) bromide (Geo)BrIr
  7629 Iridium(I) bromideBrIr
  7630 Iridium(III) oxide bromideOBrIr
  7631 Iridium(III) oxide bromide (Geo)OBrIr


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 CHARGE=-2 UHF PM7
Ir(III)NOCl4(2-) (FURCEA)
 <Ir-Cl> <><Cl-Ir-Cl> <Ir-O><><> <Ir-N> GR=CCDC
 Ir     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     2.35469100 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     2.37524394 +1   88.2431750 +1    0.0000000 +0     1     2     0
  O     2.02999700 +1   89.6201719 +1  171.7532656 +1     1     2     3
  N     2.03833300 +1   85.4063910 +1  -81.1914568 +1     1     2     4
  C     1.27388158 +1  118.6616299 +1  -93.7250107 +1     4     1     2
  O     1.22548282 +1  126.4372324 +1  178.5147568 +1     6     4     1
  C     1.52944838 +1  111.9782323 +1  107.4133681 +1     5     1     2
  C     1.52377692 +1  111.8481501 +1 -143.1400840 +1     8     5     1
  H     1.04156739 +1  112.1714210 +1 -120.7864775 +1     5     1     8
  H     1.03824776 +1  113.4201822 +1 -117.9541263 +1     5     1    10
  H     1.11460165 +1  109.1800100 +1 -123.4163312 +1     8     5     9
  H     1.08969615 +1  112.7358527 +1  -66.2375237 +1     9     8     5
  H     1.10024287 +1  109.3372205 +1 -120.7136303 +1     9     8    13
  H     1.09816322 +1  111.2509198 +1 -116.5079203 +1     9     8    14
 Cl     2.34710290 +1   94.4975336 +1  179.0565063 +1     1     2     5
 Cl     2.38063622 +1   95.6375515 +1  178.4630866 +1     1    16     2