iridium; 1-phenyl-2-[(E)-(1-phenylbenzimidazol-3-id-2-ylidene)methyl]benzimidazole; 2-phenylquinoline

Systemtic Name: iridium; 1-phenyl-2-[(E)-(1-phenylbenzimidazol-3-id-2-ylidene)methyl]benzimidazole; 2-phenylquinoline Openeye Name: iridium; 1-phenyl-2-[(E)-(1-phenylbenzimidazol-3-id-2-ylidene)methyl]benzimidazole; 2-phenylquinoline CAS Name: iridium; 1-phenyl-2-[(E)-(1-phenyl-2-benzimidazol-3-idylidene)methyl]benzimidazole; 2-phenylquinoline IUPAC Name: iridium; 1-phenyl-2-[(E)-(1-phenylbenzimidazol-3-id-2-ylidene)methyl]benzimidazole; 2-phenylquinoline Traditional Name: iridium; 1-phenyl-2-[(E)-(1-phenylbenzimidazol-3-id-2-ylidene)methyl]benzimidazole; 2-phenylquinoline Formula: C42H29IrN5-2 MolecularWeight: 795.93016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=CC=CC=C3[N-]C2=CC4=NC5=CC=CC=C5N4C6=CC=CC=C6.C1=CC=C([C-]=C1)C2=NC3=CC=CC=C3C=C2.[Ir]

Isomeric SMILES

C1=CC=C(C=C1)N\2C3=CC=CC=C3[N-]/C2=C\C4=NC5=CC=CC=C5N4C6=CC=CC=C6.C1=CC=C([C-]=C1)C2=NC3=CC=CC=C3C=C2.[Ir]

InChI

InChI=1S/C27H19N4.C15H10N.Ir/c1-3-11-20(12-4-1)30-24-17-9-7-15-22(24)28-26(30)19-27-29-23-16-8-10-18-25(23)31(27)21-13-5-2-6-14-21;1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)16-15;/h1-19H;1-6,8-11H;/q2*-1;/b26-19+;;