imidazol-3-ide; tris[2,3,4,5,6-pentakis(fluoranyl)phenyl]borane

Systemtic Name: imidazol-3-ide; tris[2,3,4,5,6-pentakis(fluoranyl)phenyl]borane Openeye Name: imidazol-3-ide; tris(2,3,4,5,6-pentafluorophenyl)borane CAS Name: imidazol-3-ide; tris(2,3,4,5,6-pentafluorophenyl)borane IUPAC Name: imidazol-3-ide; tris(2,3,4,5,6-pentafluorophenyl)borane Traditional Name: imidazol-3-ide; tris(2,3,4,5,6-pentafluorophenyl)borane Formula: C39H3B2F30N2- MolecularWeight: 1091.028616

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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.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.C1=CN=C[N-]1

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.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.C1=CN=C[N-]1

InChI

InChI=1S/2C18BF15.C3H3N2/c2*20-4-1(5(21)11(27)16(32)10(4)26)19(2-6(22)12(28)17(33)13(29)7(2)23)3-8(24)14(30)18(34)15(31)9(3)25;1-2-5-3-4-1/h;;1-3H/q;;-1