5-bromanyl-2-(4-methyl-7H-naphthalen-7-id-1-yl)pyridine; iridium(3+); 2-pyridin-2-ylbenzimidazol-1-ide

Systemtic Name: 5-bromanyl-2-(4-methyl-7H-naphthalen-7-id-1-yl)pyridine; iridium(3+); 2-pyridin-2-ylbenzimidazol-1-ide Openeye Name: 5-bromo-2-(4-methyl-7H-naphthalen-7-id-1-yl)pyridine; iridium(3+); 2-(2-pyridyl)benzimidazol-1-ide CAS Name: 5-bromo-2-(4-methyl-7H-naphthalen-7-id-1-yl)pyridine; iridium(3+); 2-(2-pyridinyl)benzimidazol-1-ide IUPAC Name: 5-bromo-2-(4-methyl-7H-naphthalen-7-id-1-yl)pyridine; iridium(3+); 2-pyridin-2-ylbenzimidazol-1-ide Traditional Name: 5-bromo-2-(4-methyl-7H-naphthalen-7-id-1-yl)pyridine; iridium(3+); 2-(2-pyridyl)benzimidazol-1-ide Formula: C44H30Br2IrN5 MolecularWeight: 980.7675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C2=C[C-]=CC=C12)C3=NC=C(C=C3)Br.CC1=CC=C(C2=C[C-]=CC=C12)C3=NC=C(C=C3)Br.C1=CC=C2C(=C1)[N-]C(=N2)C3=CC=CC=N3.[Ir+3]

Isomeric SMILES

CC1=CC=C(C2=C[C-]=CC=C12)C3=NC=C(C=C3)Br.CC1=CC=C(C2=C[C-]=CC=C12)C3=NC=C(C=C3)Br.C1=CC=C2C(=C1)[N-]C(=N2)C3=CC=CC=N3.[Ir+3]

InChI

InChI=1S/2C16H11BrN.C12H8N3.Ir/c2*1-11-6-8-15(14-5-3-2-4-13(11)14)16-9-7-12(17)10-18-16;1-2-6-10-9(5-1)14-12(15-10)11-7-3-4-8-13-11;/h2*2,4-10H,1H3;1-8H;/q3*-1;+3