ruthenium(2+); ruthenium(3+); 2-[[6-[(2-sulfanidylphenyl)sulfanylmethyl]pyridin-2-yl]methylsulfanyl]benzenethiolate; hexafluorophosphate

Systemtic Name: ruthenium(2+); ruthenium(3+); 2-[[6-[(2-sulfanidylphenyl)sulfanylmethyl]pyridin-2-yl]methylsulfanyl]benzenethiolate; hexafluorophosphate Openeye Name: ruthenium(2+); ruthenium(3+); 2-[[6-[(2-sulfidophenyl)sulfanylmethyl]-2-pyridyl]methylsulfanyl]benzenethiolate; hexafluorophosphate CAS Name: ruthenium(2+); ruthenium(3+); 2-[[6-[[(2-sulfidophenyl)thio]methyl]-2-pyridinyl]methylthio]benzenethiolate; hexafluorophosphate IUPAC Name: ruthenium(2+); ruthenium(3+); 2-[[6-[(2-sulfidophenyl)sulfanylmethyl]pyridin-2-yl]methylsulfanyl]benzenethiolate; hexafluorophosphate Traditional Name: ruthenium(2+); ruthenium(3+); 2-[[6-[[(2-sulfidophenyl)thio]methyl]-2-pyridyl]methylthio]benzenethiolate; hexafluorophosphate Formula: C38H30F6N2PRu2S8 MolecularWeight: 1118.28238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[S-])SCC2=NC(=CC=C2)CSC3=CC=CC=C3[S-].C1=CC=C(C(=C1)[S-])SCC2=NC(=CC=C2)CSC3=CC=CC=C3[S-].F[P-](F)(F)(F)(F)F.[Ru+2].[Ru+3]

Isomeric SMILES

C1=CC=C(C(=C1)[S-])SCC2=NC(=CC=C2)CSC3=CC=CC=C3[S-].C1=CC=C(C(=C1)[S-])SCC2=NC(=CC=C2)CSC3=CC=CC=C3[S-].F[P-](F)(F)(F)(F)F.[Ru+2].[Ru+3]

InChI

InChI=1S/2C19H17NS4.F6P.2Ru/c2*21-16-8-1-3-10-18(16)23-12-14-6-5-7-15(20-14)13-24-19-11-4-2-9-17(19)22;1-7(2,3,4,5)6;;/h2*1-11,21-22H,12-13H2;;;/q;;-1;+2;+3/p-4