bis(2-methylphenyl)oxidanium; tetrakis[2,3,4,5,6-pentakis(fluoranyl)phenyl]boranuide

Systemtic Name: bis(2-methylphenyl)oxidanium; tetrakis[2,3,4,5,6-pentakis(fluoranyl)phenyl]boranuide Openeye Name: bis-o-tolyloxonium; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide CAS Name: bis(2-methylphenyl)oxonium; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide IUPAC Name: bis(2-methylphenyl)oxidanium; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide Traditional Name: bis-o-tolyloxonium; tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide Formula: C38H15BF20O MolecularWeight: 878.304164

Click to see the large picture

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.CC1=CC=CC=C1[OH+]C2=CC=CC=C2C

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.CC1=CC=CC=C1[OH+]C2=CC=CC=C2C

InChI

InChI=1S/C24BF20.C14H14O/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;1-11-7-3-5-9-13(11)15-14-10-6-4-8-12(14)2/h;3-10H,1-2H3/q-1;/p+1