cyclopentane; iron(2+); 1-methyl-4-[2-[(2-methylsulfanylcyclopentyl)methyl]cyclopentyl]sulfanyl-benzene

Systemtic Name: cyclopentane; iron(2+); 1-methyl-4-[2-[(2-methylsulfanylcyclopentyl)methyl]cyclopentyl]sulfanyl-benzene Openeye Name: diferrous; cyclopentane; 1-methyl-4-[2-[(2-methylsulfanylcyclopentyl)methyl]cyclopentyl]sulfanyl-benzene CAS Name: cyclopentane; iron(2+); 1-methyl-4-[[2-[[2-(methylthio)cyclopentyl]methyl]cyclopentyl]thio]benzene IUPAC Name: cyclopentane; iron(2+); 1-methyl-4-[2-[(2-methylsulfanylcyclopentyl)methyl]cyclopentyl]sulfanylbenzene Traditional Name: diferrous; cyclopentane; 1-methyl-4-[[2-[[2-(methylthio)cyclopentyl]methyl]cyclopentyl]thio]benzene Formula: C29H28Fe2S2+4 MolecularWeight: 552.35262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S[C]2[CH][CH][CH][C]2C[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[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/C19H18S2.2C5H5.2Fe/c1-14-9-11-17(12-10-14)21-19-8-4-6-16(19)13-15-5-3-7-18(15)20-2;2*1-2-4-5-3-1;;/h3-12H,13H2,1-2H3;2*1-5H;;/q;;;2*+2