triphenyl(6-triphenylphosphaniumylhexyl)phosphanium dibromide

Systemtic Name: triphenyl(6-triphenylphosphaniumylhexyl)phosphanium dibromide Openeye Name: triphenyl(6-triphenylphosphaniumylhexyl)phosphonium dibromide CAS Name: triphenyl(6-triphenylphosphiniumylhexyl)phosphonium dibromide IUPAC Name: triphenyl(6-triphenylphosphaniumylhexyl)phosphanium dibromide Traditional Name: triphenyl(6-triphenylphosphiniumylhexyl)phosphonium dibromide Formula: C42H42Br2P2 MolecularWeight: 768.538402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CCCCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-].[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CCCCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-].[Br-]

InChI

InChI=1S/C42H42P2.2BrH/c1(21-35-43(37-23-9-3-10-24-37,38-25-11-4-12-26-38)39-27-13-5-14-28-39)2-22-36-44(40-29-15-6-16-30-40,41-31-17-7-18-32-41)42-33-19-8-20-34-42;;/h3-20,23-34H,1-2,21-22,35-36H2;2*1H/q+2;;/p-2