iridium(3+); 4-methyl-2-(4-methylpyridin-2-yl)pyridine; 2-phenylpyridine; chloride

Systemtic Name: iridium(3+); 4-methyl-2-(4-methylpyridin-2-yl)pyridine; 2-phenylpyridine; chloride Openeye Name: iridium(3+); 4-methyl-2-(4-methyl-2-pyridyl)pyridine; 2-phenylpyridine; chloride CAS Name: iridium(3+); 4-methyl-2-(4-methyl-2-pyridinyl)pyridine; 2-phenylpyridine; chloride IUPAC Name: iridium(3+); 4-methyl-2-(4-methylpyridin-2-yl)pyridine; 2-phenylpyridine; chloride Traditional Name: iridium(3+); 4-methyl-2-(4-methyl-2-pyridyl)pyridine; 2-phenylpyridine; chloride Formula: C34H28ClIrN4 MolecularWeight: 720.28292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C2=NC=CC(=C2)C.C1=CC=C([C-]=C1)C2=CC=CC=N2.C1=CC=C([C-]=C1)C2=CC=CC=N2.[Cl-].[Ir+3]

Isomeric SMILES

CC1=CC(=NC=C1)C2=NC=CC(=C2)C.C1=CC=C([C-]=C1)C2=CC=CC=N2.C1=CC=C([C-]=C1)C2=CC=CC=N2.[Cl-].[Ir+3]

InChI

InChI=1S/C12H12N2.2C11H8N.ClH.Ir/c1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;2*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;/h3-8H,1-2H3;2*1-6,8-9H;1H;/q;2*-1;;+3/p-1