chloranylcopper; pyridin-1-ium-2-thiol; triphenylphosphanium

Systemtic Name: chloranylcopper; pyridin-1-ium-2-thiol; triphenylphosphanium Openeye Name: chlorocopper; pyridin-1-ium-2-thiol; triphenylphosphonium CAS Name: chlorocopper; 2-pyridin-1-iumthiol; triphenylphosphonium IUPAC Name: chlorocopper; pyridin-1-ium-2-thiol; triphenylphosphanium Traditional Name: chlorocopper; pyridin-1-ium-2-thiol; triphenylphosphonium Formula: C41H38ClCuNP2S+3 MolecularWeight: 737.758642

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=[NH+]C(=C1)S.Cl[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=[NH+]C(=C1)S.Cl[Cu]

InChI

InChI=1S/2C18H15P.C5H5NS.ClH.Cu/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;7-5-3-1-2-4-6-5;;/h2*1-15H;1-4H,(H,6,7);1H;/q;;;;+1/p+2