3-(3-methylthiophen-2-yl)-1,5-dipyridin-4-yl-pentane-1,5-dione; 2-pyridin-2-ylpyridine; ruthenium(2+); dihexafluorophosphate

Systemtic Name: 3-(3-methylthiophen-2-yl)-1,5-dipyridin-4-yl-pentane-1,5-dione; 2-pyridin-2-ylpyridine; ruthenium(2+); dihexafluorophosphate Openeye Name: 3-(3-methyl-2-thienyl)-1,5-bis(4-pyridyl)pentane-1,5-dione; 2-(2-pyridyl)pyridine; ruthenium(2+); dihexafluorophosphate CAS Name: 3-(3-methyl-2-thiophenyl)-1,5-dipyridin-4-ylpentane-1,5-dione; 2-(2-pyridinyl)pyridine; ruthenium(2+); dihexafluorophosphate IUPAC Name: 3-(3-methylthiophen-2-yl)-1,5-dipyridin-4-ylpentane-1,5-dione; 2-pyridin-2-ylpyridine; ruthenium(2+); dihexafluorophosphate Traditional Name: 3-(3-methyl-2-thienyl)-1,5-bis(4-pyridyl)pentane-1,5-dione; 2-(2-pyridyl)pyridine; ruthenium(2+); dihexafluorophosphate Formula: C40H34F12N6O2P2RuS MolecularWeight: 1053.80032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(CC(=O)C2=CC=NC=C2)CC(=O)C3=CC=NC=C3.C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC=NC(=C1)C2=CC=CC=N2.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Ru+2]

Isomeric SMILES

CC1=C(SC=C1)C(CC(=O)C2=CC=NC=C2)CC(=O)C3=CC=NC=C3.C1=CC=NC(=C1)C2=CC=CC=N2.C1=CC=NC(=C1)C2=CC=CC=N2.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Ru+2]

InChI

InChI=1S/C20H18N2O2S.2C10H8N2.2F6P.Ru/c1-14-6-11-25-20(14)17(12-18(23)15-2-7-21-8-3-15)13-19(24)16-4-9-22-10-5-16;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;2*1-7(2,3,4,5)6;/h2-11,17H,12-13H2,1H3;2*1-8H;;;/q;;;2*-1;+2