cyclopenta-1,3-diene; iron(3+); propan-2-ylbenzene; hexafluorophosphate

Systemtic Name: cyclopenta-1,3-diene; iron(3+); propan-2-ylbenzene; hexafluorophosphate Openeye Name: ferric; cumene; cyclopenta-1,3-diene; hexafluorophosphate CAS Name: cumene; cyclopenta-1,3-diene; iron(3+); hexafluorophosphate IUPAC Name: cumene; cyclopenta-1,3-diene; iron(3+); hexafluorophosphate Traditional Name: ferric; cumene; cyclopenta-1,3-diene; hexafluorophosphate Formula: C14H17F6FeP+ MolecularWeight: 386.09396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1.C1C=CC=[C-]1.F[P-](F)(F)(F)(F)F.[Fe+3]

Isomeric SMILES

CC(C)C1=CC=CC=C1.C1C=CC=[C-]1.F[P-](F)(F)(F)(F)F.[Fe+3]

InChI

InChI=1S/C9H12.C5H5.F6P.Fe/c1-8(2)9-6-4-3-5-7-9;1-2-4-5-3-1;1-7(2,3,4,5)6;/h3-8H,1-2H3;1-3H,4H2;;/q;2*-1;+3