ethanenitrile; 1,10-phenanthroline; 2-phenylpyridine; ruthenium(2+); hexafluorophosphate

Systemtic Name: ethanenitrile; 1,10-phenanthroline; 2-phenylpyridine; ruthenium(2+); hexafluorophosphate Openeye Name: acetonitrile; 1,10-phenanthroline; 2-phenylpyridine; ruthenium(2+); hexafluorophosphate CAS Name: acetonitrile; 1,10-phenanthroline; 2-phenylpyridine; ruthenium(2+); hexafluorophosphate IUPAC Name: acetonitrile; 1,10-phenanthroline; 2-phenylpyridine; ruthenium(2+); hexafluorophosphate Traditional Name: acetonitrile; 1,10-phenanthroline; 2-phenylpyridine; ruthenium(2+); hexafluorophosphate Formula: C27H22F6N5PRu MolecularWeight: 662.53126

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.CC#N.C1=CC=C([C-]=C1)C2=CC=CC=N2.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.F[P-](F)(F)(F)(F)F.[Ru+2]

Isomeric SMILES

CC#N.CC#N.C1=CC=C([C-]=C1)C2=CC=CC=N2.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.F[P-](F)(F)(F)(F)F.[Ru+2]

InChI

InChI=1S/C12H8N2.C11H8N.2C2H3N.F6P.Ru/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;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;/h1-8H;1-6,8-9H;2*1H3;;/q;-1;;;-1;+2