2-(3H-1-benzothiophen-3-id-2-yl)pyridine; 6-(2-bromophenyl)-3H-pyridin-3-ide; iridium(3+)

Systemtic Name: 2-(3H-1-benzothiophen-3-id-2-yl)pyridine; 6-(2-bromophenyl)-3H-pyridin-3-ide; iridium(3+) Openeye Name: 2-(3H-benzothiophen-3-id-2-yl)pyridine; 6-(2-bromophenyl)-3H-pyridin-3-ide; iridium(3+) CAS Name: 2-(3H-1-benzothiophen-3-id-2-yl)pyridine; 6-(2-bromophenyl)-3H-pyridin-3-ide; iridium(3+) IUPAC Name: 2-(3H-1-benzothiophen-3-id-2-yl)pyridine; 6-(2-bromophenyl)-3H-pyridin-3-ide; iridium(3+) Traditional Name: 2-(3H-benzothiophen-3-id-2-yl)pyridine; 6-(2-bromophenyl)-3H-pyridin-3-ide; iridium(3+) Formula: C35H22Br2IrN3S MolecularWeight: 868.65928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[C-]=C(S2)C3=CC=CC=N3.C1=CC=C(C(=C1)C2=CC=[C-]C=N2)Br.C1=CC=C(C(=C1)C2=CC=[C-]C=N2)Br.[Ir+3]

Isomeric SMILES

C1=CC=C2C(=C1)[C-]=C(S2)C3=CC=CC=N3.C1=CC=C(C(=C1)C2=CC=[C-]C=N2)Br.C1=CC=C(C(=C1)C2=CC=[C-]C=N2)Br.[Ir+3]

InChI

InChI=1S/C13H8NS.2C11H7BrN.Ir/c1-2-7-12-10(5-1)9-13(15-12)11-6-3-4-8-14-11;2*12-10-6-2-1-5-9(10)11-7-3-4-8-13-11;/h1-8H;2*1-3,5-8H;/q3*-1;+3