iridium; (Z)-4-oxidanylpent-3-en-2-one; 2-(2H-pyren-2-id-1-yl)-2H-quinolin-1-ide

Systemtic Name: iridium; (Z)-4-oxidanylpent-3-en-2-one; 2-(2H-pyren-2-id-1-yl)-2H-quinolin-1-ide Openeye Name: (Z)-4-hydroxypent-3-en-2-one; iridium; 2-(2H-pyren-2-id-1-yl)-2H-quinolin-1-ide CAS Name: (Z)-4-hydroxy-3-penten-2-one; iridium; 2-(2H-pyren-2-id-1-yl)-2H-quinolin-1-ide IUPAC Name: (Z)-4-hydroxypent-3-en-2-one; iridium; 2-(2H-pyren-2-id-1-yl)-2H-quinolin-1-ide Traditional Name: (Z)-4-hydroxypent-3-en-2-one; iridium; 2-(2H-pyren-2-id-1-yl)-2H-quinolin-1-ide Formula: C30H23IrNO2-2 MolecularWeight: 621.72612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)O.C1=CC=C2C(=C1)C=CC([N-]2)C3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=[C-]3.[Ir]

Isomeric SMILES

C/C(=C/C(=O)C)/O.C1=CC=C2C(=C1)C=CC([N-]2)C3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=[C-]3.[Ir]

InChI

InChI=1S/C25H15N.C5H8O2.Ir/c1-2-7-22-16(4-1)12-15-23(26-22)20-13-10-19-9-8-17-5-3-6-18-11-14-21(20)25(19)24(17)18;1-4(6)3-5(2)7;/h1-12,14-15,23H;3,6H,1-2H3;/q-2;;/b;4-3-;