benzenethiolate; 1,2,3,4,5-pentamethylcyclopenta-1,3-diene; ruthenium; chloride

Systemtic Name: benzenethiolate; 1,2,3,4,5-pentamethylcyclopenta-1,3-diene; ruthenium; chloride Openeye Name: benzenethiolate; 1,2,3,4,5-pentamethylcyclopenta-1,3-diene; ruthenium; chloride CAS Name: benzenethiolate; 1,2,3,4,5-pentamethylcyclopenta-1,3-diene; ruthenium; chloride IUPAC Name: benzenethiolate; 1,2,3,4,5-pentamethylcyclopenta-1,3-diene; ruthenium; chloride Traditional Name: benzenethiolate; 1,2,3,4,5-pentamethylcyclopenta-1,3-diene; ruthenium; chloride Formula: C38H47ClRu2S3-4 MolecularWeight: 837.56778

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=C(C(=C1C)C)C)C.CC1C(=C(C(=C1C)C)C)C.C1=CC=C(C=C1)[S-].C1=CC=C(C=C1)[S-].C1=CC=C(C=C1)[S-].[Cl-].[Ru].[Ru]

Isomeric SMILES

CC1C(=C(C(=C1C)C)C)C.CC1C(=C(C(=C1C)C)C)C.C1=CC=C(C=C1)[S-].C1=CC=C(C=C1)[S-].C1=CC=C(C=C1)[S-].[Cl-].[Ru].[Ru]

InChI

InChI=1S/2C10H16.3C6H6S.ClH.2Ru/c2*1-6-7(2)9(4)10(5)8(6)3;3*7-6-4-2-1-3-5-6;;;/h2*6H,1-5H3;3*1-5,7H;1H;;/p-4