[(4-methylphenyl)-triphenylphosphaniumyl-methyl]-triphenyl-phosphanium; tetraphenylboranuide

Systemtic Name: [(4-methylphenyl)-triphenylphosphaniumyl-methyl]-triphenyl-phosphanium; tetraphenylboranuide Openeye Name: tetraphenylboranuide; triphenyl-[p-tolyl(triphenylphosphaniumyl)methyl]phosphonium CAS Name: [(4-methylphenyl)-triphenylphosphiniumylmethyl]-triphenylphosphonium; tetraphenylboranuide IUPAC Name: [(4-methylphenyl)-triphenylphosphaniumylmethyl]-triphenylphosphanium; tetraphenylboranuide Traditional Name: tetraphenylboranuide; triphenyl-[p-tolyl(triphenylphosphiniumyl)methyl]phosphonium Formula: C92H78B2P2 MolecularWeight: 1267.173242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC1=CC=C(C=C1)C([P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CC1=CC=C(C=C1)C([P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C44H38P2.2C24H20B/c1-36-32-34-37(35-33-36)44(45(38-20-8-2-9-21-38,39-22-10-3-11-23-39)40-24-12-4-13-25-40)46(41-26-14-5-15-27-41,42-28-16-6-17-29-42)43-30-18-7-19-31-43;2*1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h2-35,44H,1H3;2*1-20H/q+2;2*-1