(1E)-1,5-diphenylpenta-1,4-dien-3-one; palladium; palladium(2+)

Systemtic Name: (1E)-1,5-diphenylpenta-1,4-dien-3-one; palladium; palladium(2+) Openeye Name: (1E)-1,5-diphenylpenta-1,4-dien-3-one; palladium; palladium(2+) CAS Name: (1E)-1,5-diphenyl-3-penta-1,4-dienone; palladium; palladium(2+) IUPAC Name: (1E)-1,5-diphenylpenta-1,4-dien-3-one; palladium; palladium(2+) Traditional Name: (1E)-1,5-diphenylpenta-1,4-dien-3-one; palladium; palladium(2+) Formula: C51H39O3Pd3+ MolecularWeight: 1019.11356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)[C-]=CC2=CC=CC=C2.C1=CC=C(C=C1)C=CC(=O)[C-]=CC2=CC=CC=C2.C1=CC=C(C=C1)C=CC(=O)[C-]=CC2=CC=CC=C2.[Pd].[Pd+2].[Pd+2]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)[C-]=CC2=CC=CC=C2.C1=CC=C(C=C1)/C=C/C(=O)[C-]=CC2=CC=CC=C2.C1=CC=C(C=C1)/C=C/C(=O)[C-]=CC2=CC=CC=C2.[Pd].[Pd+2].[Pd+2]

InChI

InChI=1S/3C17H13O.3Pd/c3*18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16;;;/h3*1-13H;;;/q3*-1;;2*+2/b3*13-11+;;;