N-diphenylphosphanylethanamide; ethanenitrile; ethanone; palladium(2+); hexafluorophosphate

Systemtic Name: N-diphenylphosphanylethanamide; ethanenitrile; ethanone; palladium(2+); hexafluorophosphate Openeye Name: acetonitrile; N-diphenylphosphanylacetamide; ethanone; palladium(2+); hexafluorophosphate CAS Name: acetonitrile; N-diphenylphosphinoacetamide; ethanone; palladium(2+); hexafluorophosphate IUPAC Name: acetonitrile; N-diphenylphosphanylacetamide; ethanone; palladium(2+); hexafluorophosphate Traditional Name: acetonitrile; N-diphenylphosphinoacetamide; ethanone; palladium(2+); hexafluorophosphate Formula: C18H20F6N2O2P2Pd MolecularWeight: 578.721541

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Descriptors Computed from Structure

Canonical SMILES:

C[C-]=O.CC#N.CC(=O)NP(C1=CC=CC=C1)C2=CC=CC=C2.F[P-](F)(F)(F)(F)F.[Pd+2]

Isomeric SMILES

C[C-]=O.CC#N.CC(=O)NP(C1=CC=CC=C1)C2=CC=CC=C2.F[P-](F)(F)(F)(F)F.[Pd+2]

InChI

InChI=1S/C14H14NOP.C2H3N.C2H3O.F6P.Pd/c1-12(16)15-17(13-8-4-2-5-9-13)14-10-6-3-7-11-14;2*1-2-3;1-7(2,3,4,5)6;/h2-11H,1H3,(H,15,16);2*1H3;;/q;;2*-1;+2