2-methyl-3-(3-pyrazin-2-ylpyrazin-2-yl)pyrazine; 1,10-phenanthroline; ruthenium

Systemtic Name: 2-methyl-3-(3-pyrazin-2-ylpyrazin-2-yl)pyrazine; 1,10-phenanthroline; ruthenium Openeye Name: 2-methyl-3-(3-pyrazin-2-ylpyrazin-2-yl)pyrazine; 1,10-phenanthroline; ruthenium CAS Name: 2-methyl-3-[3-(2-pyrazinyl)-2-pyrazinyl]pyrazine; 1,10-phenanthroline; ruthenium IUPAC Name: 2-methyl-3-(3-pyrazin-2-ylpyrazin-2-yl)pyrazine; 1,10-phenanthroline; ruthenium Traditional Name: 2-methyl-3-(3-pyrazin-2-ylpyrazin-2-yl)pyrazine; 1,10-phenanthroline; ruthenium Formula: C85H58N18Ru3 MolecularWeight: 1634.70062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN=C1C2=NC=CN=C2C3=NC=CN=C3.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[Ru].[Ru].[Ru]

Isomeric SMILES

CC1=NC=CN=C1C2=NC=CN=C2C3=NC=CN=C3.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[Ru].[Ru].[Ru]

InChI

InChI=1S/C13H10N6.6C12H8N2.3Ru/c1-9-11(17-5-4-15-9)13-12(18-6-7-19-13)10-8-14-2-3-16-10;6*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;;;/h2-8H,1H3;6*1-8H;;;