N,N-bis(diphenylphosphanylmethyl)-2-methyl-propan-2-amine; ethanenitrile; palladium(2+); diperchlorate

Systemtic Name: N,N-bis(diphenylphosphanylmethyl)-2-methyl-propan-2-amine; ethanenitrile; palladium(2+); diperchlorate Openeye Name: acetonitrile; N,N-bis(diphenylphosphanylmethyl)-2-methyl-propan-2-amine; palladium(2+); diperchlorate CAS Name: acetonitrile; N,N-bis(diphenylphosphinomethyl)-2-methyl-2-propanamine; palladium(2+); diperchlorate IUPAC Name: acetonitrile; N,N-bis(diphenylphosphanylmethyl)-2-methylpropan-2-amine; palladium(2+); diperchlorate Traditional Name: acetonitrile; tert-butyl-bis(diphenylphosphinomethyl)amine; palladium(2+); diperchlorate Formula: C34H39Cl2N3O8P2Pd MolecularWeight: 856.962282

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.CC#N.CC(C)(C)N(CP(C1=CC=CC=C1)C2=CC=CC=C2)CP(C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Pd+2]

Isomeric SMILES

CC#N.CC#N.CC(C)(C)N(CP(C1=CC=CC=C1)C2=CC=CC=C2)CP(C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Pd+2]

InChI

InChI=1S/C30H33NP2.2C2H3N.2ClHO4.Pd/c1-30(2,3)31(24-32(26-16-8-4-9-17-26)27-18-10-5-11-19-27)25-33(28-20-12-6-13-21-28)29-22-14-7-15-23-29;2*1-2-3;2*2-1(3,4)5;/h4-23H,24-25H2,1-3H3;2*1H3;2*(H,2,3,4,5);/q;;;;;+2/p-2