but-1-ene; 2-diphenylphosphaniumylethyl(diphenyl)phosphanium; palladium; tris(fluoranyl)methanesulfonate

Systemtic Name: but-1-ene; 2-diphenylphosphaniumylethyl(diphenyl)phosphanium; palladium; tris(fluoranyl)methanesulfonate Openeye Name: but-1-ene; 2-diphenylphosphaniumylethyl(diphenyl)phosphonium; palladium; trifluoromethanesulfonate CAS Name: 1-butene; 2-diphenylphosphiniumylethyl(diphenyl)phosphonium; palladium; trifluoromethanesulfonate IUPAC Name: but-1-ene; 2-diphenylphosphaniumylethyl(diphenyl)phosphanium; palladium; trifluoromethanesulfonate Traditional Name: but-1-ene; 2-diphenylphosphiniumylethyl(diphenyl)phosphonium; palladium; triflate Formula: C31H33F3O3P2PdS MolecularWeight: 711.019652

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Descriptors Computed from Structure

Canonical SMILES:

C[CH-]C=C.C1=CC=C(C=C1)[PH+](CC[PH+](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-]C=C.C1=CC=C(C=C1)[PH+](CC[PH+](C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C(F)(F)(F)S(=O)(=O)[O-].[Pd]

InChI

InChI=1S/C26H24P2.C4H7.CHF3O3S.Pd/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-4-2;2-1(3,4)8(5,6)7;/h1-20H,21-22H2;3-4H,1H2,2H3;(H,5,6,7);/q;-1;;/p+1