cyclopenta-1,3-diene; iron(3+); pyrene; dihexafluorophosphate

Systemtic Name: cyclopenta-1,3-diene; iron(3+); pyrene; dihexafluorophosphate Openeye Name: ferric; cyclopenta-1,3-diene; pyrene; dihexafluorophosphate CAS Name: cyclopenta-1,3-diene; iron(3+); pyrene; dihexafluorophosphate IUPAC Name: cyclopenta-1,3-diene; iron(3+); pyrene; dihexafluorophosphate Traditional Name: ferric; cyclopenta-1,3-diene; pyrene; dihexafluorophosphate Formula: C21H15F12FeP2 MolecularWeight: 613.11716

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=[C-]1.C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Fe+3]

Isomeric SMILES

C1C=CC=[C-]1.C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Fe+3]

InChI

InChI=1S/C16H10.C5H5.2F6P.Fe/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14;1-2-4-5-3-1;2*1-7(2,3,4,5)6;/h1-10H;1-3H,4H2;;;/q;3*-1;+3