iridium; pentane-2,4-diol; 1-phenylisoquinoline

Systemtic Name: iridium; pentane-2,4-diol; 1-phenylisoquinoline Openeye Name: iridium; pentane-2,4-diol; 1-phenylisoquinoline CAS Name: iridium; pentane-2,4-diol; 1-phenylisoquinoline IUPAC Name: iridium; pentane-2,4-diol; 1-phenylisoquinoline Traditional Name: iridium; pentane-2,4-diol; 1-phenylisoquinoline Formula: C20H22IrNO2- MolecularWeight: 500.61118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)O)O.C1=CC=C([C-]=C1)C2=NC=CC3=CC=CC=C32.[Ir]

Isomeric SMILES

CC(CC(C)O)O.C1=CC=C([C-]=C1)C2=NC=CC3=CC=CC=C32.[Ir]

InChI

InChI=1S/C15H10N.C5H12O2.Ir/c1-2-7-13(8-3-1)15-14-9-5-4-6-12(14)10-11-16-15;1-4(6)3-5(2)7;/h1-7,9-11H;4-7H,3H2,1-2H3;/q-1;;