4-methylbenzenesulfonate; ruthenium(2+); hexahydrate

Systemtic Name: 4-methylbenzenesulfonate; ruthenium(2+); hexahydrate Openeye Name: 4-methylbenzenesulfonate; ruthenium(2+); hexahydrate CAS Name: 4-methylbenzenesulfonate; ruthenium(2+); hexahydrate IUPAC Name: 4-methylbenzenesulfonate; ruthenium(2+); hexahydrate Traditional Name: ruthenium(2+) ditosylate hexahydrate Formula: C14H26O12RuS2 MolecularWeight: 551.54904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].O.O.O.O.O.O.[Ru+2]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-].O.O.O.O.O.O.[Ru+2]

InChI

InChI=1S/2C7H8O3S.6H2O.Ru/c2*1-6-2-4-7(5-3-6)11(8,9)10;;;;;;;/h2*2-5H,1H3,(H,8,9,10);6*1H2;/q;;;;;;;;+2/p-2