benzenethiolate; cyclopentane; diphenylphosphanylmethyl(diphenyl)phosphane; ruthenium(2+)

Systemtic Name: benzenethiolate; cyclopentane; diphenylphosphanylmethyl(diphenyl)phosphane; ruthenium(2+) Openeye Name: benzenethiolate; cyclopentane; diphenylphosphanylmethyl(diphenyl)phosphane; ruthenium(2+) CAS Name: benzenethiolate; cyclopentane; diphenylphosphinomethyl(diphenyl)phosphine; ruthenium(2+) IUPAC Name: benzenethiolate; cyclopentane; diphenylphosphanylmethyl(diphenyl)phosphane; ruthenium(2+) Traditional Name: benzenethiolate; cyclopentane; diphenylphosphinomethyl(diphenyl)phosphine; ruthenium(2+) Formula: C36H32P2RuS+ MolecularWeight: 659.721802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)[S-].[CH]1[CH][CH][CH][CH]1.[Ru+2]

Isomeric SMILES

C1=CC=C(C=C1)P(CP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)[S-].[CH]1[CH][CH][CH][CH]1.[Ru+2]

InChI

InChI=1S/C25H22P2.C6H6S.C5H5.Ru/c1-5-13-22(14-6-1)26(23-15-7-2-8-16-23)21-27(24-17-9-3-10-18-24)25-19-11-4-12-20-25;7-6-4-2-1-3-5-6;1-2-4-5-3-1;/h1-20H,21H2;1-5,7H;1-5H;/q;;;+2/p-1