cyclopentane; 1,2,3,4,5,6-hexakis(but-3-enyl)benzene; iron(2+); hexafluorophosphate

Systemtic Name: cyclopentane; 1,2,3,4,5,6-hexakis(but-3-enyl)benzene; iron(2+); hexafluorophosphate Openeye Name: ferrous; cyclopentane; 1,2,3,4,5,6-hexakis(but-3-enyl)benzene; hexafluorophosphate CAS Name: cyclopentane; 1,2,3,4,5,6-hexakis(but-3-enyl)benzene; iron(2+); hexafluorophosphate IUPAC Name: cyclopentane; 1,2,3,4,5,6-hexakis(but-3-enyl)benzene; iron(2+); hexafluorophosphate Traditional Name: ferrous; cyclopentane; 1,2,3,4,5,6-hexakis(but-3-enyl)benzene; hexafluorophosphate Formula: C35H47F6FeP+ MolecularWeight: 668.55686

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC1=C(C(=C(C(=C1CCC=C)CCC=C)CCC=C)CCC=C)CCC=C.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Fe+2]

Isomeric SMILES

C=CCCC1=C(C(=C(C(=C1CCC=C)CCC=C)CCC=C)CCC=C)CCC=C.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Fe+2]

InChI

InChI=1S/C30H42.C5H5.F6P.Fe/c1-7-13-19-25-26(20-14-8-2)28(22-16-10-4)30(24-18-12-6)29(23-17-11-5)27(25)21-15-9-3;1-2-4-5-3-1;1-7(2,3,4,5)6;/h7-12H,1-6,13-24H2;1-5H;;/q;;-1;+2