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cyclopentane; iron(2+); 2,3,4,5-tetra(cyclopentyl)cyclopenta-2,4-dien-1-one

Systemtic Name:	cyclopentane; iron(2+); 2,3,4,5-tetra(cyclopentyl)cyclopenta-2,4-dien-1-one
Openeye Name:	tetraferrous; cyclopentane; 2,3,4,5-tetra(cyclopentyl)cyclopenta-2,4-dien-1-one
CAS Name:	cyclopentane; iron(2+); 2,3,4,5-tetra(cyclopentyl)-1-cyclopenta-2,4-dienone
IUPAC Name:	cyclopentane; iron(2+); 2,3,4,5-tetra(cyclopentyl)cyclopenta-2,4-dien-1-one
Traditional Name:	tetraferrous; cyclopentane; 2,3,4,5-tetra(cyclopentyl)cyclopenta-2,4-dien-1-one
Formula:	C₄₅H₃₆Fe₄O+8
MolecularWeight:	816.14674

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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][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][C]([CH]1)C2=C(C(=O)C(=C2[C]3[CH][CH][CH][CH]3)[C]4[CH][CH][CH][CH]4)[C]5[CH][CH][CH][CH]5.[Fe+2].[Fe+2].[Fe+2].[Fe+2]

Isomeric SMILES

InChI

InChI=1S/C25H16O.4C5H5.4Fe/c26-25-23(19-13-5-6-14-19)21(17-9-1-2-10-17)22(18-11-3-4-12-18)24(25)20-15-7-8-16-20;4*1-2-4-5-3-1;;;;/h1-16H;4*1-5H;;;;/q;;;;;4*+2

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