ethanenitrile; 4-methyl-2-(4-methylpyridin-2-yl)pyridine; 2-phenylpyridine; ruthenium(1+); hexafluorophosphate

Systemtic Name: ethanenitrile; 4-methyl-2-(4-methylpyridin-2-yl)pyridine; 2-phenylpyridine; ruthenium(1+); hexafluorophosphate Openeye Name: acetonitrile; 4-methyl-2-(4-methyl-2-pyridyl)pyridine; 2-phenylpyridine; ruthenium(1+); hexafluorophosphate CAS Name: acetonitrile; 4-methyl-2-(4-methyl-2-pyridinyl)pyridine; 2-phenylpyridine; ruthenium(1+); hexafluorophosphate IUPAC Name: acetonitrile; 4-methyl-2-(4-methylpyridin-2-yl)pyridine; 2-phenylpyridine; ruthenium(1+); hexafluorophosphate Traditional Name: acetonitrile; 4-methyl-2-(4-methyl-2-pyridyl)pyridine; 2-phenylpyridine; ruthenium(1+); hexafluorophosphate Formula: C27H27F6N5PRu MolecularWeight: 667.57096

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.CC#N.CC1=CC(=NC=C1)C2=NC=CC(=C2)C.C1=CC=C(C=C1)C2=CC=CC=N2.F[P-](F)(F)(F)(F)F.[Ru+]

Isomeric SMILES

CC#N.CC#N.CC1=CC(=NC=C1)C2=NC=CC(=C2)C.C1=CC=C(C=C1)C2=CC=CC=N2.F[P-](F)(F)(F)(F)F.[Ru+]

InChI

InChI=1S/C12H12N2.C11H9N.2C2H3N.F6P.Ru/c1-9-3-5-13-11(7-9)12-8-10(2)4-6-14-12;1-2-6-10(7-3-1)11-8-4-5-9-12-11;2*1-2-3;1-7(2,3,4,5)6;/h3-8H,1-2H3;1-9H;2*1H3;;/q;;;;-1;+1