3-diphenylphosphanylpropyl(diphenyl)phosphane; ethanenitrile; palladium(2+); dihexafluorophosphate

Systemtic Name: 3-diphenylphosphanylpropyl(diphenyl)phosphane; ethanenitrile; palladium(2+); dihexafluorophosphate Openeye Name: acetonitrile; 3-diphenylphosphanylpropyl(diphenyl)phosphane; palladium(2+); dihexafluorophosphate CAS Name: acetonitrile; 3-diphenylphosphinopropyl(diphenyl)phosphine; palladium(2+); dihexafluorophosphate IUPAC Name: acetonitrile; 3-diphenylphosphanylpropyl(diphenyl)phosphane; palladium(2+); dihexafluorophosphate Traditional Name: acetonitrile; 3-diphenylphosphinopropyl(diphenyl)phosphine; palladium(2+); dihexafluorophosphate Formula: C31H32F12N2P4Pd MolecularWeight: 890.895062

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.CC#N.C1=CC=C(C=C1)P(CCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Pd+2]

Isomeric SMILES

CC#N.CC#N.C1=CC=C(C=C1)P(CCCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Pd+2]

InChI

InChI=1S/C27H26P2.2C2H3N.2F6P.Pd/c1-5-14-24(15-6-1)28(25-16-7-2-8-17-25)22-13-23-29(26-18-9-3-10-19-26)27-20-11-4-12-21-27;2*1-2-3;2*1-7(2,3,4,5)6;/h1-12,14-21H,13,22-23H2;2*1H3;;;/q;;;2*-1;+2