cyclopentane; (S)-cyclopentyl-(2-methylsulfanylcyclopentyl)-phenyl-methanol; iron(2+)

Systemtic Name: cyclopentane; (S)-cyclopentyl-(2-methylsulfanylcyclopentyl)-phenyl-methanol; iron(2+) Openeye Name: diferrous; cyclopentane; (S)-cyclopentyl-(2-methylsulfanylcyclopentyl)-phenyl-methanol CAS Name: cyclopentane; (S)-cyclopentyl-[2-(methylthio)cyclopentyl]-phenylmethanol; iron(2+) IUPAC Name: cyclopentane; (S)-cyclopentyl-(2-methylsulfanylcyclopentyl)-phenylmethanol; iron(2+) Traditional Name: diferrous; cyclopentane; (S)-cyclopentyl-[2-(methylthio)cyclopentyl]-phenyl-methanol Formula: C28H26Fe2OS+4 MolecularWeight: 522.26044

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Descriptors Computed from Structure

Canonical SMILES:

CS[C]1[CH][CH][CH][C]1C(C2=CC=CC=C2)([C]3[CH][CH][CH][CH]3)O.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

Isomeric SMILES

CS[C]1[CH][CH][CH][C]1[C@](C2=CC=CC=C2)([C]3[CH][CH][CH][CH]3)O.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

InChI

InChI=1S/C18H16OS.2C5H5.2Fe/c1-20-17-13-7-12-16(17)18(19,15-10-5-6-11-15)14-8-3-2-4-9-14;2*1-2-4-5-3-1;;/h2-13,19H,1H3;2*1-5H;;/q;;;2*+2/t18-;;;;/m0..../s1