[4-[[4-(2-iodaniumylphenyl)phenyl]methyl]phenyl]-diphenyl-sulfanium; tetrakis[2,3,4,5,6-pentakis(fluoranyl)phenyl]boranuide

Systemtic Name: [4-[[4-(2-iodaniumylphenyl)phenyl]methyl]phenyl]-diphenyl-sulfanium; tetrakis[2,3,4,5,6-pentakis(fluoranyl)phenyl]boranuide Openeye Name: [4-[[4-(2-iodoniophenyl)phenyl]methyl]phenyl]-diphenyl-sulfonium; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide CAS Name: [4-[[4-(2-iodoniophenyl)phenyl]methyl]phenyl]-diphenylsulfonium; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide IUPAC Name: [4-[[4-(2-iodoniophenyl)phenyl]methyl]phenyl]-diphenylsulfanium; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide Traditional Name: [4-[4-(2-iodoniophenyl)benzyl]phenyl]-diphenyl-sulfonium; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide Formula: C79H25B2F40IS MolecularWeight: 1914.571398

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=C(C(=C(C(=C1F)F)F)F)F)(C2=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.[B-](C1=C(C(=C(C(=C1F)F)F)F)F)(C2=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=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=C(C=C3)CC4=CC=C(C=C4)C5=CC=CC=C5[IH+]

Isomeric SMILES

[B-](C1=C(C(=C(C(=C1F)F)F)F)F)(C2=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.[B-](C1=C(C(=C(C(=C1F)F)F)F)F)(C2=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=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=C(C=C3)CC4=CC=C(C=C4)C5=CC=CC=C5[IH+]

InChI

InChI=1S/C31H25IS.2C24BF20/c32-31-14-8-7-13-30(31)26-19-15-24(16-20-26)23-25-17-21-29(22-18-25)33(27-9-3-1-4-10-27)28-11-5-2-6-12-28;2*26-5-1(6(27)14(35)21(42)13(5)34)25(2-7(28)15(36)22(43)16(37)8(2)29,3-9(30)17(38)23(44)18(39)10(3)31)4-11(32)19(40)24(45)20(41)12(4)33/h1-22,32H,23H2;;/q+2;2*-1