1-[2,4-bis[2,3,4,5,6-pentakis(fluoranyl)phenyl]cyclopenta-2,4-dien-1-yl]-2,3,4,5,6-pentakis(fluoranyl)benzene; iron

Systemtic Name: 1-[2,4-bis[2,3,4,5,6-pentakis(fluoranyl)phenyl]cyclopenta-2,4-dien-1-yl]-2,3,4,5,6-pentakis(fluoranyl)benzene; iron Openeye Name: 1-[2,4-bis(2,3,4,5,6-pentafluorophenyl)cyclopenta-2,4-dien-1-yl]-2,3,4,5,6-pentafluoro-benzene; iron CAS Name: 1-[2,4-bis(2,3,4,5,6-pentafluorophenyl)-1-cyclopenta-2,4-dienyl]-2,3,4,5,6-pentafluorobenzene; iron IUPAC Name: 1-[2,4-bis(2,3,4,5,6-pentafluorophenyl)cyclopenta-2,4-dien-1-yl]-2,3,4,5,6-pentafluorobenzene; iron Traditional Name: 1-[2,4-bis(2,3,4,5,6-pentafluorophenyl)cyclopenta-2,4-dien-1-yl]-2,3,4,5,6-pentafluoro-benzene; iron Formula: C46H4F30Fe-2 MolecularWeight: 1182.321056

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C([C-]1C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F.C1=C(C=C([C-]1C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F.[Fe]

Isomeric SMILES

C1=C(C=C([C-]1C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F.C1=C(C=C([C-]1C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F)C4=C(C(=C(C(=C4F)F)F)F)F.[Fe]

InChI

InChI=1S/2C23H2F15.Fe/c2*24-9-6(10(25)16(31)21(36)15(9)30)3-1-4(7-11(26)17(32)22(37)18(33)12(7)27)5(2-3)8-13(28)19(34)23(38)20(35)14(8)29;/h2*1-2H;/q2*-1;