cyclopentane; iron(2+); 4-methylhepta-1,6-dien-4-ylbenzene; hexafluorophosphate

Systemtic Name: cyclopentane; iron(2+); 4-methylhepta-1,6-dien-4-ylbenzene; hexafluorophosphate Openeye Name: ferrous; (1-allyl-1-methyl-but-3-enyl)benzene; cyclopentane; hexafluorophosphate CAS Name: cyclopentane; iron(2+); 4-methylhepta-1,6-dien-4-ylbenzene; hexafluorophosphate IUPAC Name: cyclopentane; iron(2+); 4-methylhepta-1,6-dien-4-ylbenzene; hexafluorophosphate Traditional Name: ferrous; (1-allyl-1-methyl-but-3-enyl)benzene; cyclopentane; hexafluorophosphate Formula: C19H23F6FeP+ MolecularWeight: 452.1951

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=C)(CC=C)C1=CC=CC=C1.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Fe+2]

Isomeric SMILES

CC(CC=C)(CC=C)C1=CC=CC=C1.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Fe+2]

InChI

InChI=1S/C14H18.C5H5.F6P.Fe/c1-4-11-14(3,12-5-2)13-9-7-6-8-10-13;1-2-4-5-3-1;1-7(2,3,4,5)6;/h4-10H,1-2,11-12H2,3H3;1-5H;;/q;;-1;+2