butane; 4-diphenylphosphanylbutyl(diphenyl)phosphane; palladium; tris(fluoranyl)methanesulfonic acid

Systemtic Name: butane; 4-diphenylphosphanylbutyl(diphenyl)phosphane; palladium; tris(fluoranyl)methanesulfonic acid Openeye Name: butane; 4-diphenylphosphanylbutyl(diphenyl)phosphane; palladium; trifluoromethanesulfonic acid CAS Name: butane; 4-diphenylphosphinobutyl(diphenyl)phosphine; palladium; trifluoromethanesulfonic acid IUPAC Name: butane; 4-diphenylphosphanylbutyl(diphenyl)phosphane; palladium; trifluoromethanesulfonic acid Traditional Name: butane; 4-diphenylphosphinobutyl(diphenyl)phosphine; palladium; triflic acid Formula: C33H36F3O3P2PdS MolecularWeight: 738.064872

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Descriptors Computed from Structure

Canonical SMILES:

C[CH][CH][CH2].C1=CC=C(C=C1)P(CCCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)O.[Pd]

Isomeric SMILES

C[CH][CH][CH2].C1=CC=C(C=C1)P(CCCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)O.[Pd]

InChI

InChI=1S/C28H28P2.C4H7.CHF3O3S.Pd/c1-5-15-25(16-6-1)29(26-17-7-2-8-18-26)23-13-14-24-30(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-3-4-2;2-1(3,4)8(5,6)7;/h1-12,15-22H,13-14,23-24H2;3-4H,1H2,2H3;(H,5,6,7);