methanidylbenzene; palladium(2+); triphenylphosphane; chloride

Systemtic Name: methanidylbenzene; palladium(2+); triphenylphosphane; chloride Openeye Name: methanidylbenzene; palladium(2+); triphenylphosphane; chloride CAS Name: methanidylbenzene; palladium(2+); triphenylphosphine; chloride IUPAC Name: methanidylbenzene; palladium(2+); triphenylphosphane; chloride Traditional Name: methanidylbenzene; palladium(2+); triphenylphosphine; chloride Formula: C79H67ClP4Pd MolecularWeight: 1282.145324

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Descriptors Computed from Structure

Canonical SMILES:

[CH2-]C1=CC=CC=C1.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.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Pd+2]

Isomeric SMILES

[CH2-]C1=CC=CC=C1.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.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Pd+2]

InChI

InChI=1S/4C18H15P.C7H7.ClH.Pd/c4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-7-5-3-2-4-6-7;;/h4*1-15H;2-6H,1H2;1H;/q;;;;-1;;+2/p-1