2-(4-fluorophenyl)-7H-benzo[e]benzotriazol-7-ide; iridium(3+); chloride

Systemtic Name: 2-(4-fluorophenyl)-7H-benzo[e]benzotriazol-7-ide; iridium(3+); chloride Openeye Name: 2-(4-fluorophenyl)-7H-benzo[e]benzotriazol-7-ide; iridium(3+); chloride CAS Name: 2-(4-fluorophenyl)-7H-benzo[e]benzotriazol-7-ide; iridium(3+); chloride IUPAC Name: 2-(4-fluorophenyl)-7H-benzo[e]benzotriazol-7-ide; iridium(3+); chloride Traditional Name: 2-(4-fluorophenyl)-7H-benzo[e]benzotriazol-7-ide; iridium(3+); chloride Formula: C32H18ClF2IrN6 MolecularWeight: 752.192326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2N=C3C=CC4=C[C-]=CC=C4C3=N2)F.C1=CC(=CC=C1N2N=C3C=CC4=C[C-]=CC=C4C3=N2)F.[Cl-].[Ir+3]

Isomeric SMILES

C1=CC(=CC=C1N2N=C3C=CC4=C[C-]=CC=C4C3=N2)F.C1=CC(=CC=C1N2N=C3C=CC4=C[C-]=CC=C4C3=N2)F.[Cl-].[Ir+3]

InChI

InChI=1S/2C16H9FN3.ClH.Ir/c2*17-12-6-8-13(9-7-12)20-18-15-10-5-11-3-1-2-4-14(11)16(15)19-20;;/h2*2-10H;1H;/q2*-1;;+3/p-1