triphenyl-(4-triphenylphosphaniumylphenyl)phosphanium; tris(fluoranyl)methanesulfonate

Systemtic Name: triphenyl-(4-triphenylphosphaniumylphenyl)phosphanium; tris(fluoranyl)methanesulfonate Openeye Name: trifluoromethanesulfonate; triphenyl-(4-triphenylphosphaniumylphenyl)phosphonium CAS Name: trifluoromethanesulfonate; triphenyl-(4-triphenylphosphiniumylphenyl)phosphonium IUPAC Name: trifluoromethanesulfonate; triphenyl-(4-triphenylphosphaniumylphenyl)phosphanium Traditional Name: triphenyl-(4-triphenylphosphiniumylphenyl)phosphonium ditriflate Formula: C44H34F6O6P2S2 MolecularWeight: 898.805101

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C42H34P2.2CHF3O3S/c1-7-19-35(20-8-1)43(36-21-9-2-10-22-36,37-23-11-3-12-24-37)41-31-33-42(34-32-41)44(38-25-13-4-14-26-38,39-27-15-5-16-28-39)40-29-17-6-18-30-40;2*2-1(3,4)8(5,6)7/h1-34H;2*(H,5,6,7)/q+2;;/p-2