1,4-bis(4-chloranylphenoxy)benzene; cyclopentane; iron; dihexafluorophosphate

Systemtic Name: 1,4-bis(4-chloranylphenoxy)benzene; cyclopentane; iron; dihexafluorophosphate Openeye Name: 1,4-bis(4-chlorophenoxy)benzene; cyclopentane; iron; dihexafluorophosphate CAS Name: 1,4-bis(4-chlorophenoxy)benzene; cyclopentane; iron; dihexafluorophosphate IUPAC Name: 1,4-bis(4-chlorophenoxy)benzene; cyclopentane; iron; dihexafluorophosphate Traditional Name: 1,4-bis(4-chlorophenoxy)benzene; cyclopentane; iron; dihexafluorophosphate Formula: C28H22Cl2F12Fe2O2P2-2 MolecularWeight: 862.99744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Fe].[Fe]

Isomeric SMILES

C1=CC(=CC=C1OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Fe].[Fe]

InChI

InChI=1S/C18H12Cl2O2.2C5H5.2F6P.2Fe/c19-13-1-5-15(6-2-13)21-17-9-11-18(12-10-17)22-16-7-3-14(20)4-8-16;2*1-2-4-5-3-1;2*1-7(2,3,4,5)6;;/h1-12H;2*1-5H;;;;/q;;;2*-1;;