tris(chloranyl)iridium; tris(2-methylphenyl)phosphane

Systemtic Name: tris(chloranyl)iridium; tris(2-methylphenyl)phosphane Openeye Name: trichloroiridium; tris-o-tolylphosphane CAS Name: trichloroiridium; tris(2-methylphenyl)phosphine IUPAC Name: trichloroiridium; tris(2-methylphenyl)phosphane Traditional Name: trichloroiridium; tris-o-tolylphosphine Formula: C63H63Cl3IrP3 MolecularWeight: 1211.671603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.Cl[Ir](Cl)Cl

Isomeric SMILES

CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.CC1=CC=CC=C1P(C2=CC=CC=C2C)C3=CC=CC=C3C.Cl[Ir](Cl)Cl

InChI

InChI=1S/3C21H21P.3ClH.Ir/c3*1-16-10-4-7-13-19(16)22(20-14-8-5-11-17(20)2)21-15-9-6-12-18(21)3;;;;/h3*4-15H,1-3H3;3*1H;/q;;;;;;+3/p-3