4,7-diphenyl-1,10-phenanthroline; ruthenium(4+); tetraperchlorate

Systemtic Name: 4,7-diphenyl-1,10-phenanthroline; ruthenium(4+); tetraperchlorate Openeye Name: 4,7-diphenyl-1,10-phenanthroline; ruthenium(4+); tetraperchlorate CAS Name: 4,7-diphenyl-1,10-phenanthroline; ruthenium(4+); tetraperchlorate IUPAC Name: 4,7-diphenyl-1,10-phenanthroline; ruthenium(4+); tetraperchlorate Traditional Name: 4,7-diphenyl-1,10-phenanthroline; ruthenium(4+); tetraperchlorate Formula: C72H48Cl4N6O16Ru MolecularWeight: 1496.06412

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.C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ru+4]

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.C1=CC=C(C=C1)C2=C3C=CC4=C(C=CN=C4C3=NC=C2)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Ru+4]

InChI

InChI=1S/3C24H16N2.4ClHO4.Ru/c3*1-3-7-17(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;4*2-1(3,4)5;/h3*1-16H;4*(H,2,3,4,5);/q;;;;;;;+4/p-4