bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate

C62H44F18N16P3Ru2 — CID 11980900

About bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate

bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate (PubChem CID 11980900) has the molecular formula C62H44F18N16P3Ru2 and a molecular weight of 1650.17 g/mol. Its IUPAC name is bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate.

Molecular Properties

• Compound Name: bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate
• PubChem CID: 11980900
• Molecular Formula: C62H44F18N16P3Ru2
• Molecular Weight: 1650.17 g/mol
• Exact Mass: 1651.09
• IUPAC Name: bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate
• SMILES: F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Ru+2].[Ru+3].c1cc(-c2nc3ccccc3[n-]2)nc(-c2nc3ccccc3[nH]2)c1.c1cc(-c2nc3ccccc3[n-]2)nc(-c2nc3ccccc3[nH]2)c1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1cnccn1
• InChI: InChI=1S/2C19H12N5.2C10H8N2.C4H4N2.3F6P.2Ru/c2*1-2-7-13-12(6-1)21-18(22-13)16-10-5-11-17(20-16)19-23-14-8-3-4-9-15(14)24-19;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-2-6-4-3-5-1;3*1-7(2,3,4,5)6;;/h2*1-11H,(H-,21,22,23,24);2*1-8H;1-4H;;;;;/q2*-1;;;;3*-1;+2;+3
• InChIKey: MPEPIQGEMUTMQI-UHFFFAOYSA-N
• XLogP: 22.50
• TPSA: 214.46 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 12
• Rotatable Bonds: 6
• Heavy Atoms: 101
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1650.17
LogP ≤ 5	22.50
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate?

The IUPAC name of bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate (CID 11980900) is bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate.

What is the SMILES notation for bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate?

The canonical SMILES for bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate is F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Ru+2].[Ru+3].c1cc(-c2nc3ccccc3[n-]2)nc(-c2nc3ccccc3[nH]2)c1.c1cc(-c2nc3ccccc3[n-]2)nc(-c2nc3ccccc3[nH]2)c1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1cnccn1.

What is the InChIKey of bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate?

The InChIKey is MPEPIQGEMUTMQI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H12N5.2C10H8N2.C4H4N2.3F6P.2Ru/c2*1-2-7-13-12(6-1)21-18(22-13)16-10-5-11-17(20-16)19-23-14-8-3-4-9-15(14)24-19;2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-2-6-4-3-5-1;3*1-7(2,3,4,5)6;;/h2*1-11H,(H-,21,22,23,24);2*1-8H;1-4H;;;;;/q2*-1;;;;3*-1;+2;+3.

What are the key properties of bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate?

bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate has a molecular weight of 1650.17 g/mol, XLogP of 22.50, 6 rotatable bonds, 2 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-ide);pyrazine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);ruthenium(3+);trihexafluorophosphate is sourced from PubChem (CID 11980900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).