(2,6-dipyridin-2-ylpyridin-4-yl)-diphenyl-phosphane; ruthenium(2+); dihexafluorophosphate

Systemtic Name: (2,6-dipyridin-2-ylpyridin-4-yl)-diphenyl-phosphane; ruthenium(2+); dihexafluorophosphate Openeye Name: [2,6-bis(2-pyridyl)-4-pyridyl]-diphenyl-phosphane; ruthenium(2+); dihexafluorophosphate CAS Name: [2,6-bis(2-pyridinyl)-4-pyridinyl]-diphenylphosphine; ruthenium(2+); dihexafluorophosphate IUPAC Name: (2,6-dipyridin-2-ylpyridin-4-yl)-diphenylphosphane; ruthenium(2+); dihexafluorophosphate Traditional Name: [2,6-bis(2-pyridyl)-4-pyridyl]-diphenyl-phosphine; ruthenium(2+); dihexafluorophosphate Formula: C54H40F12N6P4Ru MolecularWeight: 1225.881482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC(=NC(=C3)C4=CC=CC=N4)C5=CC=CC=N5.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC(=NC(=C3)C4=CC=CC=N4)C5=CC=CC=N5.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Ru+2]

Isomeric SMILES

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC(=NC(=C3)C4=CC=CC=N4)C5=CC=CC=N5.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC(=NC(=C3)C4=CC=CC=N4)C5=CC=CC=N5.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Ru+2]

InChI

InChI=1S/2C27H20N3P.2F6P.Ru/c2*1-3-11-21(12-4-1)31(22-13-5-2-6-14-22)23-19-26(24-15-7-9-17-28-24)30-27(20-23)25-16-8-10-18-29-25;2*1-7(2,3,4,5)6;/h2*1-20H;;;/q;;2*-1;+2