iridium(3-); 2-phenyl-1,3-benzothiazole; quinolin-8-ol

Systemtic Name: iridium(3-); 2-phenyl-1,3-benzothiazole; quinolin-8-ol Openeye Name: iridium(3-); 2-phenyl-1,3-benzothiazole; quinolin-8-ol CAS Name: iridium(3-); 2-phenyl-1,3-benzothiazole; 8-quinolinol IUPAC Name: iridium(3-); 2-phenyl-1,3-benzothiazole; quinolin-8-ol Traditional Name: iridium(3-); oxine; 2-phenyl-1,3-benzothiazole Formula: C35H23IrN3OS2-5 MolecularWeight: 757.92362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C([C-]=C1)C2=NC3=CC=CC=C3S2.C1=CC=C([C-]=C1)C2=NC3=CC=CC=C3S2.C1=CC2=C(C(=C1)O)N=CC=C2.[Ir-3]

Isomeric SMILES

C1=CC=C([C-]=C1)C2=NC3=CC=CC=C3S2.C1=CC=C([C-]=C1)C2=NC3=CC=CC=C3S2.C1=CC2=C(C(=C1)O)N=CC=C2.[Ir-3]

InChI

InChI=1S/2C13H8NS.C9H7NO.Ir/c2*1-2-6-10(7-3-1)13-14-11-8-4-5-9-12(11)15-13;11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,8-9H;1-6,11H;/q2*-1;;-3