4,6-bis[(E)-2-cyclopentylethenyl]pyrimidine; cyclopentane; iron(2+)

Systemtic Name: 4,6-bis[(E)-2-cyclopentylethenyl]pyrimidine; cyclopentane; iron(2+) Openeye Name: diferrous; 4,6-bis[(E)-2-cyclopentylvinyl]pyrimidine; cyclopentane CAS Name: 4,6-bis[(E)-2-cyclopentylethenyl]pyrimidine; cyclopentane; iron(2+) IUPAC Name: 4,6-bis[(E)-2-cyclopentylethenyl]pyrimidine; cyclopentane; iron(2+) Traditional Name: diferrous; 4,6-bis[(E)-2-cyclopentylvinyl]pyrimidine; cyclopentane Formula: C28H25Fe2N2+4 MolecularWeight: 501.2015

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Descriptors Computed from Structure

Canonical SMILES:

[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH]C([CH]1)C=CC2=NC=NC(=C2)C=C[C]3[CH][CH][CH][CH]3.[Fe+2].[Fe+2]

Isomeric SMILES

[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH]C([CH]1)/C=C/C2=NC=NC(=C2)/C=C/[C]3[CH][CH][CH][CH]3.[Fe+2].[Fe+2]

InChI

InChI=1S/C18H15N2.2C5H5.2Fe/c1-2-6-15(5-1)9-11-17-13-18(20-14-19-17)12-10-16-7-3-4-8-16;2*1-2-4-5-3-1;;/h1-15H;2*1-5H;;/q;;;2*+2/b11-9+;;;;