benzenecarbonitrile; chloranylpalladium(1+); triphenylphosphane

Systemtic Name: benzenecarbonitrile; chloranylpalladium(1+); triphenylphosphane Openeye Name: benzonitrile; chloropalladium(1+); triphenylphosphane CAS Name: benzonitrile; chloropalladium(1+); triphenylphosphine IUPAC Name: benzonitrile; chloropalladium(1+); triphenylphosphane Traditional Name: benzonitrile; chloropalladium(1+); triphenylphosphine Formula: C43H34ClNP2Pd MolecularWeight: 768.557282

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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(=CC=[C-]1)C#N.Cl[Pd+]

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(=CC=[C-]1)C#N.Cl[Pd+]

InChI

InChI=1S/2C18H15P.C7H4N.ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;8-6-7-4-2-1-3-5-7;;/h2*1-15H;2-5H;1H;/q;;-1;;+2/p-1