cyclopentane; [(1E)-3-cyclopentyl-1,4,4-trideuterio-1-methylsulfanyl-buta-1,3-dien-2-yl]cyclopentane; iron(2+)

Systemtic Name: cyclopentane; [(1E)-3-cyclopentyl-1,4,4-trideuterio-1-methylsulfanyl-buta-1,3-dien-2-yl]cyclopentane; iron(2+) Openeye Name: diferrous; cyclopentane; [(E)-2-cyclopentyl-3-deuterio-1-(dideuteriomethylene)-3-methylsulfanyl-allyl]cyclopentane CAS Name: cyclopentane; [(1E)-3-cyclopentyl-1,4,4-trideuterio-1-(methylthio)buta-1,3-dien-2-yl]cyclopentane; iron(2+) IUPAC Name: cyclopentane; [(1E)-3-cyclopentyl-1,4,4-trideuterio-1-methylsulfanylbuta-1,3-dien-2-yl]cyclopentane; iron(2+) Traditional Name: diferrous; cyclopentane; [(E)-2-cyclopentyl-3-deuterio-1-(dideuteriomethylene)-3-(methylthio)allyl]cyclopentane Formula: C25H24Fe2S+4 MolecularWeight: 471.231545

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Descriptors Computed from Structure

Canonical SMILES:

CSC=C([C]1[CH][CH][CH][CH]1)C(=C)[C]2[CH][CH][CH][CH]2.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

Isomeric SMILES

[2H]C(=C([C]1[CH][CH][CH][CH]1)/C(=C(\[2H])/SC)/[C]2[CH][CH][CH][CH]2)[2H].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe+2].[Fe+2]

InChI

InChI=1S/C15H14S.2C5H5.2Fe/c1-12(13-7-3-4-8-13)15(11-16-2)14-9-5-6-10-14;2*1-2-4-5-3-1;;/h3-11H,1H2,2H3;2*1-5H;;/q;;;2*+2/i1D2,11D;;;;