ethanenitrile; palladium(2+); 2-[3-(pyridin-2-ylmethyl)-2H-imidazol-1-yl]pyrimidine; dihexafluorophosphate

Systemtic Name: ethanenitrile; palladium(2+); 2-[3-(pyridin-2-ylmethyl)-2H-imidazol-1-yl]pyrimidine; dihexafluorophosphate Openeye Name: acetonitrile; palladium(2+); 2-[3-(2-pyridylmethyl)-2H-imidazol-1-yl]pyrimidine; dihexafluorophosphate CAS Name: acetonitrile; palladium(2+); 2-[3-(2-pyridinylmethyl)-2H-imidazol-1-yl]pyrimidine; dihexafluorophosphate IUPAC Name: acetonitrile; palladium(2+); 2-[3-(pyridin-2-ylmethyl)-2H-imidazol-1-yl]pyrimidine; dihexafluorophosphate Traditional Name: acetonitrile; palladium(2+); 2-[3-(2-pyridylmethyl)-4-imidazolin-1-yl]pyrimidine; dihexafluorophosphate Formula: C17H19F12N7P2Pd MolecularWeight: 717.72802

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.CC#N.C1N(C=CN1C2=NC=CC=N2)CC3=CC=CC=N3.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Pd+2]

Isomeric SMILES

CC#N.CC#N.C1N(C=CN1C2=NC=CC=N2)CC3=CC=CC=N3.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Pd+2]

InChI

InChI=1S/C13H13N5.2C2H3N.2F6P.Pd/c1-2-5-14-12(4-1)10-17-8-9-18(11-17)13-15-6-3-7-16-13;2*1-2-3;2*1-7(2,3,4,5)6;/h1-9H,10-11H2;2*1H3;;;/q;;;2*-1;+2