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

Systemtic Name: cyclopentane; 1-[2-(cyclopentylmethyl)cyclopentyl]sulfanyl-4-methyl-benzene; iron(2+) Openeye Name: diferrous; cyclopentane; 1-[2-(cyclopentylmethyl)cyclopentyl]sulfanyl-4-methyl-benzene CAS Name: cyclopentane; 1-[[2-(cyclopentylmethyl)cyclopentyl]thio]-4-methylbenzene; iron(2+) IUPAC Name: cyclopentane; 1-[2-(cyclopentylmethyl)cyclopentyl]sulfanyl-4-methylbenzene; iron(2+) Traditional Name: diferrous; cyclopentane; 1-[[2-(cyclopentylmethyl)cyclopentyl]thio]-4-methyl-benzene Formula: C28H26Fe2S+4 MolecularWeight: 506.26104

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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][CH]3.[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][CH]3.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

InChI

InChI=1S/C18H16S.2C5H5.2Fe/c1-14-9-11-17(12-10-14)19-18-8-4-7-16(18)13-15-5-2-3-6-15;2*1-2-4-5-3-1;;/h2-12H,13H2,1H3;2*1-5H;;/q;;;2*+2