copper; 2-cyanoethanoic acid; triphenylphosphane

Systemtic Name: copper; 2-cyanoethanoic acid; triphenylphosphane Openeye Name: copper; 2-cyanoacetic acid; triphenylphosphane CAS Name: copper; 2-cyanoacetic acid; triphenylphosphine IUPAC Name: copper; 2-cyanoacetic acid; triphenylphosphane Traditional Name: copper; 2-cyanoacetic acid; triphenylphosphine Formula: C78H66Cu2N2O4P4 MolecularWeight: 1346.356684

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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.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C(C#N)C(=O)O.C(C#N)C(=O)O.[Cu].[Cu]

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.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C(C#N)C(=O)O.C(C#N)C(=O)O.[Cu].[Cu]

InChI

InChI=1S/4C18H15P.2C3H3NO2.2Cu/c4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*4-2-1-3(5)6;;/h4*1-15H;2*1H2,(H,5,6);;