methanolate; tetrakis[2,3,4,5,6-pentakis(fluoranyl)phenyl]boranuide; tris(fluoranyl)methanesulfonate; zirconium(4+)

Systemtic Name: methanolate; tetrakis[2,3,4,5,6-pentakis(fluoranyl)phenyl]boranuide; tris(fluoranyl)methanesulfonate; zirconium(4+) Openeye Name: methanolate; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide; trifluoromethanesulfonate; zirconium(4+) CAS Name: methanolate; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide; trifluoromethanesulfonate; zirconium(4+) IUPAC Name: methanolate; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide; trifluoromethanesulfonate; zirconium(4+) Traditional Name: methanolate; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide; zirconium(4+); triflate Formula: C27H6BF23O5SZr MolecularWeight: 981.396814

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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.C[O-].C[O-].C(F)(F)(F)S(=O)(=O)[O-].[Zr+4]

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.C[O-].C[O-].C(F)(F)(F)S(=O)(=O)[O-].[Zr+4]

InChI

InChI=1S/C24BF20.CHF3O3S.2CH3O.Zr/c26-5-1(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;2-1(3,4)8(5,6)7;2*1-2;/h;(H,5,6,7);2*1H3;/q-1;;2*-1;+4/p-1