10H-benzo[h]quinolin-10-ide; iridium(3-); (Z)-4-oxidanylpent-3-en-2-one

Systemtic Name: 10H-benzo[h]quinolin-10-ide; iridium(3-); (Z)-4-oxidanylpent-3-en-2-one Openeye Name: 10H-benzo[h]quinolin-10-ide; (Z)-4-hydroxypent-3-en-2-one; iridium(3-) CAS Name: 10H-benzo[h]quinolin-10-ide; (Z)-4-hydroxy-3-penten-2-one; iridium(3-) IUPAC Name: 10H-benzo[h]quinolin-10-ide; (Z)-4-hydroxypent-3-en-2-one; iridium(3-) Traditional Name: 10H-benzo[h]quinolin-10-ide; (Z)-4-hydroxypent-3-en-2-one; iridium(3-) Formula: C31H24IrN2O2-5 MolecularWeight: 648.75146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)O.C1=CC2=C([C-]=C1)C3=C(C=CC=N3)C=C2.C1=CC2=C([C-]=C1)C3=C(C=CC=N3)C=C2.[Ir-3]

Isomeric SMILES

C/C(=C/C(=O)C)/O.C1=CC2=C([C-]=C1)C3=C(C=CC=N3)C=C2.C1=CC2=C([C-]=C1)C3=C(C=CC=N3)C=C2.[Ir-3]

InChI

InChI=1S/2C13H8N.C5H8O2.Ir/c2*1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12;1-4(6)3-5(2)7;/h2*1-5,7-9H;3,6H,1-2H3;/q2*-1;;-3/b;;4-3-;