copper(1+); 2,2-dicyanoethenylideneazanide; triphenylphosphanium

Systemtic Name: copper(1+); 2,2-dicyanoethenylideneazanide; triphenylphosphanium Openeye Name: dicuprous; 2,2-dicyanoethenylideneazanide; triphenylphosphonium CAS Name: copper(1+); 2,2-dicyanoethenylideneazanide; triphenylphosphonium IUPAC Name: copper(1+); 2,2-dicyanoethenylideneazanide; triphenylphosphanium Traditional Name: dicuprous; 2,2-dicyanoethenylideneazanide; triphenylphosphonium Formula: C80H64Cu2N6P4+4 MolecularWeight: 1360.391404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C(=C(C#N)C#N)=[N-].C(=C(C#N)C#N)=[N-].[Cu+].[Cu+]

Isomeric SMILES

C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C(=C(C#N)C#N)=[N-].C(=C(C#N)C#N)=[N-].[Cu+].[Cu+]

InChI

InChI=1S/4C18H15P.2C4N3.2Cu/c4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*5-1-4(2-6)3-7;;/h4*1-15H;;;;/q;;;;2*-1;2*+1/p+4