4,7-diphenyl-1,10-phenanthroline; ruthenium(2+); chloride; pentahydrate

Systemtic Name: 4,7-diphenyl-1,10-phenanthroline; ruthenium(2+); chloride; pentahydrate Openeye Name: 4,7-diphenyl-1,10-phenanthroline; ruthenium(2+); chloride; pentahydrate CAS Name: 4,7-diphenyl-1,10-phenanthroline; ruthenium(2+); chloride; pentahydrate IUPAC Name: 4,7-diphenyl-1,10-phenanthroline; ruthenium(2+); chloride; pentahydrate Traditional Name: 4,7-diphenyl-1,10-phenanthroline; ruthenium(2+); chloride; pentahydrate Formula: C24H26ClN2O5Ru+ MolecularWeight: 558.99664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.O.O.O.O.O.[Cl-].[Ru+2]

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.O.O.O.O.O.[Cl-].[Ru+2]

InChI

InChI=1S/C24H16N2.ClH.5H2O.Ru/c1-3-7-17(8-4-1)19-13-15-25-23-21(19)11-12-22-20(14-16-26-24(22)23)18-9-5-2-6-10-18;;;;;;;/h1-16H;1H;5*1H2;/q;;;;;;;+2/p-1