cyclopentane; iron(2+); [2-(4-methylphenyl)sulfanylcyclopentyl]-(2-methylsulfanylcyclopentyl)methanone

Systemtic Name: cyclopentane; iron(2+); [2-(4-methylphenyl)sulfanylcyclopentyl]-(2-methylsulfanylcyclopentyl)methanone Openeye Name: diferrous; cyclopentane; (2-methylsulfanylcyclopentyl)-[2-(p-tolylsulfanyl)cyclopentyl]methanone CAS Name: cyclopentane; iron(2+); [2-[(4-methylphenyl)thio]cyclopentyl]-[2-(methylthio)cyclopentyl]methanone IUPAC Name: cyclopentane; iron(2+); [2-(4-methylphenyl)sulfanylcyclopentyl]-(2-methylsulfanylcyclopentyl)methanone Traditional Name: diferrous; cyclopentane; [2-(methylthio)cyclopentyl]-[2-(p-tolylthio)cyclopentyl]methanone Formula: C29H26Fe2OS2+4 MolecularWeight: 566.33614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S[C]2[CH][CH][CH][C]2C(=O)[C]3[CH][CH][CH][C]3SC.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

Isomeric SMILES

CC1=CC=C(C=C1)S[C]2[CH][CH][CH][C]2C(=O)[C]3[CH][CH][CH][C]3SC.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

InChI

InChI=1S/C19H16OS2.2C5H5.2Fe/c1-13-9-11-14(12-10-13)22-18-8-4-6-16(18)19(20)15-5-3-7-17(15)21-2;2*1-2-4-5-3-1;;/h3-12H,1-2H3;2*1-5H;;/q;;;2*+2