bis(4-fluorophenyl)iodanium; tris(fluoranyl)methanesulfonate

Systemtic Name: bis(4-fluorophenyl)iodanium; tris(fluoranyl)methanesulfonate Openeye Name: bis(4-fluorophenyl)iodonium; trifluoromethanesulfonate CAS Name: bis(4-fluorophenyl)iodonium; trifluoromethanesulfonate IUPAC Name: bis(4-fluorophenyl)iodanium; trifluoromethanesulfonate Traditional Name: bis(4-fluorophenyl)iodonium triflate Formula: C13H8F5IO3S MolecularWeight: 466.162306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1F)[I+]C2=CC=C(C=C2)F.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1F)[I+]C2=CC=C(C=C2)F.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C12H8F2I.CHF3O3S/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12;2-1(3,4)8(5,6)7/h1-8H;(H,5,6,7)/q+1;/p-1