iridium; pyridine-2-carboxylic acid; 4-pyridin-2-ylbenzene-5-ide-1-carbonitrile

Systemtic Name: iridium; pyridine-2-carboxylic acid; 4-pyridin-2-ylbenzene-5-ide-1-carbonitrile Openeye Name: iridium; pyridine-2-carboxylic acid; 4-(2-pyridyl)benzene-5-ide-1-carbonitrile CAS Name: iridium; 2-pyridinecarboxylic acid; 4-(2-pyridinyl)-1-benzene-5-idecarbonitrile IUPAC Name: iridium; pyridine-2-carboxylic acid; 4-pyridin-2-ylbenzene-5-ide-1-carbonitrile Traditional Name: iridium; picolinic acid; 4-(2-pyridyl)benzene-5-ide-1-carbonitrile Formula: C18H12IrN3O2- MolecularWeight: 494.52378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC=C(C=[C-]2)C#N.C1=CC=NC(=C1)C(=O)O.[Ir]

Isomeric SMILES

C1=CC=NC(=C1)C2=CC=C(C=[C-]2)C#N.C1=CC=NC(=C1)C(=O)O.[Ir]

InChI

InChI=1S/C12H7N2.C6H5NO2.Ir/c13-9-10-4-6-11(7-5-10)12-3-1-2-8-14-12;8-6(9)5-3-1-2-4-7-5;/h1-6,8H;1-4H,(H,8,9);/q-1;;