Tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum

C₆₀H₄₄Mo₂N₁₂ — CID 139137105

About Tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum

Tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum (PubChem CID 139137105) has the molecular formula C₆₀H₄₄Mo₂N₁₂ and a molecular weight of 1124.98 g/mol. Its IUPAC name is tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum.

Molecular Properties

• Compound Name: Tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum
• PubChem CID: 139137105
• Molecular Formula: C₆₀H₄₄Mo₂N₁₂
• Molecular Weight: 1124.98 g/mol
• Exact Mass: 1128.19
• IUPAC Name: tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum
• SMILES: [Mo].[Mo].c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(-c2cccc(-c3ccccn3)n2)nc1
• InChI: InChI=1S/4C15H11N3.2Mo/c4*1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;;/h4*1-11H
• InChIKey: MDNHKULKUYDECU-UHFFFAOYSA-N
• XLogP: 12.82
• TPSA: 154.68 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 8
• Heavy Atoms: 74
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1124.98
LogP ≤ 5	12.82
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of Tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum?

The IUPAC name of Tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum (CID 139137105) is tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum.

What is the SMILES notation for Tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum?

The canonical SMILES for Tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum is [Mo].[Mo].c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(-c2cccc(-c3ccccn3)n2)nc1.

What is the InChIKey of Tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum?

The InChIKey is MDNHKULKUYDECU-UHFFFAOYSA-N. The full InChI is InChI=1S/4C15H11N3.2Mo/c4*1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;;/h4*1-11H;;.

What are the key properties of Tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum?

Tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum has a molecular weight of 1124.98 g/mol, XLogP of 12.82, 8 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for Tetrakis(2,6-dipyridin-2-ylpyridine);molybdenum is sourced from PubChem (CID 139137105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 139137105 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.