2,3-dipyridin-2-ylquinoxaline; ruthenium(2+); ditetrafluoroborate

Systemtic Name: 2,3-dipyridin-2-ylquinoxaline; ruthenium(2+); ditetrafluoroborate Openeye Name: 2,3-bis(2-pyridyl)quinoxaline; ruthenium(2+); ditetrafluoroborate CAS Name: 2,3-bis(2-pyridinyl)quinoxaline; ruthenium(2+); ditetrafluoroborate IUPAC Name: 2,3-dipyridin-2-ylquinoxaline; ruthenium(2+); ditetrafluoroborate Traditional Name: 2,3-bis(2-pyridyl)quinoxaline; ruthenium(2+); ditetrafluoroborate Formula: C54H36B2F8N12Ru MolecularWeight: 1127.623266

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC=C2C(=C1)N=C(C(=N2)C3=CC=CC=N3)C4=CC=CC=N4.C1=CC=C2C(=C1)N=C(C(=N2)C3=CC=CC=N3)C4=CC=CC=N4.C1=CC=C2C(=C1)N=C(C(=N2)C3=CC=CC=N3)C4=CC=CC=N4.[Ru+2]

Isomeric SMILES

[B-](F)(F)(F)F.[B-](F)(F)(F)F.C1=CC=C2C(=C1)N=C(C(=N2)C3=CC=CC=N3)C4=CC=CC=N4.C1=CC=C2C(=C1)N=C(C(=N2)C3=CC=CC=N3)C4=CC=CC=N4.C1=CC=C2C(=C1)N=C(C(=N2)C3=CC=CC=N3)C4=CC=CC=N4.[Ru+2]

InChI

InChI=1S/3C18H12N4.2BF4.Ru/c3*1-2-8-14-13(7-1)21-17(15-9-3-5-11-19-15)18(22-14)16-10-4-6-12-20-16;2*2-1(3,4)5;/h3*1-12H;;;/q;;;2*-1;+2