iridium(3-); (Z)-4-oxidanylpent-3-en-2-one; 2-(3H-thiophen-3-id-2-yl)pyridine

Systemtic Name: iridium(3-); (Z)-4-oxidanylpent-3-en-2-one; 2-(3H-thiophen-3-id-2-yl)pyridine Openeye Name: (Z)-4-hydroxypent-3-en-2-one; iridium(3-); 2-(3H-thiophen-3-id-2-yl)pyridine CAS Name: (Z)-4-hydroxy-3-penten-2-one; iridium(3-); 2-(3H-thiophen-3-id-2-yl)pyridine IUPAC Name: (Z)-4-hydroxypent-3-en-2-one; iridium(3-); 2-(3H-thiophen-3-id-2-yl)pyridine Traditional Name: (Z)-4-hydroxypent-3-en-2-one; iridium(3-); 2-(3H-thiophen-3-id-2-yl)pyridine Formula: C23H20IrN2O2S2-5 MolecularWeight: 612.7641

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)O.C1=CC=NC(=C1)C2=[C-]C=CS2.C1=CC=NC(=C1)C2=[C-]C=CS2.[Ir-3]

Isomeric SMILES

C/C(=C/C(=O)C)/O.C1=CC=NC(=C1)C2=[C-]C=CS2.C1=CC=NC(=C1)C2=[C-]C=CS2.[Ir-3]

InChI

InChI=1S/2C9H6NS.C5H8O2.Ir/c2*1-2-6-10-8(4-1)9-5-3-7-11-9;1-4(6)3-5(2)7;/h2*1-4,6-7H;3,6H,1-2H3;/q2*-1;;-3/b;;4-3-;