triphenylphosphane; tris(chloranyl)iridium

Systemtic Name: triphenylphosphane; tris(chloranyl)iridium Openeye Name: trichloroiridium; triphenylphosphane CAS Name: trichloroiridium; triphenylphosphine IUPAC Name: trichloroiridium; triphenylphosphane Traditional Name: trichloroiridium; triphenylphosphine Formula: C54H45Cl3IrP3 MolecularWeight: 1085.432383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Ir](Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Ir](Cl)Cl

InChI

InChI=1S/3C18H15P.3ClH.Ir/c3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;;/h3*1-15H;3*1H;/q;;;;;;+3/p-3