iron(2+); 1,4,4,6-tetra(cyclopentyl)hexan-3-one

Systemtic Name: iron(2+); 1,4,4,6-tetra(cyclopentyl)hexan-3-one Openeye Name: diferrous 1,4,4,6-tetra(cyclopentyl)hexan-3-one CAS Name: iron(2+); 1,4,4,6-tetra(cyclopentyl)-3-hexanone IUPAC Name: iron(2+); 1,4,4,6-tetra(cyclopentyl)hexan-3-one Traditional Name: diferrous 1,4,4,6-tetra(cyclopentyl)hexan-3-one Formula: C26H24Fe2O+4 MolecularWeight: 464.15816

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Descriptors Computed from Structure

Canonical SMILES:

[CH]1[CH][CH][C]([CH]1)CCC(=O)C(CC[C]2[CH][CH][CH][CH]2)([C]3[CH][CH][CH][CH]3)[C]4[CH][CH][CH][CH]4.[Fe+2].[Fe+2]

Isomeric SMILES

[CH]1[CH][CH][C]([CH]1)CCC(=O)C(CC[C]2[CH][CH][CH][CH]2)([C]3[CH][CH][CH][CH]3)[C]4[CH][CH][CH][CH]4.[Fe+2].[Fe+2]

InChI

InChI=1S/C26H24O.2Fe/c27-25(18-17-21-9-1-2-10-21)26(23-13-5-6-14-23,24-15-7-8-16-24)20-19-22-11-3-4-12-22;;/h1-16H,17-20H2;;/q;2*+2