Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine)

C₄₂H₃₀Ag₃N₉ — CID 139163297

About Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine)

Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine) (PubChem CID 139163297) has the molecular formula C₄₂H₃₀Ag₃N₉ and a molecular weight of 984.37 g/mol. Its IUPAC name is trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine).

Molecular Properties

• Compound Name: Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine)
• PubChem CID: 139163297
• Molecular Formula: C₄₂H₃₀Ag₃N₉
• Molecular Weight: 984.37 g/mol
• Exact Mass: 980.98
• IUPAC Name: trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine)
• SMILES: [Ag+].[Ag+].[Ag+].c1ccc(-c2ccc(-c3ccccn3)[n-]2)nc1.c1ccc(-c2ccc(-c3ccccn3)[n-]2)nc1.c1ccc(-c2ccc(-c3ccccn3)[n-]2)nc1
• InChI: InChI=1S/3C14H10N3.3Ag/c3*1-3-9-15-11(5-1)13-7-8-14(17-13)12-6-2-4-10-16-12;;;/h3*1-10H;;;/q3*-1;3*+1
• InChIKey: PFKIOPDUPCUBEN-UHFFFAOYSA-N
• XLogP: 8.30
• TPSA: 119.64 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 54
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	984.37
LogP ≤ 5	8.30
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine)?

The IUPAC name of Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine) (CID 139163297) is trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine).

What is the SMILES notation for Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine)?

The canonical SMILES for Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine) is [Ag+].[Ag+].[Ag+].c1ccc(-c2ccc(-c3ccccn3)[n-]2)nc1.c1ccc(-c2ccc(-c3ccccn3)[n-]2)nc1.c1ccc(-c2ccc(-c3ccccn3)[n-]2)nc1.

What is the InChIKey of Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine)?

The InChIKey is PFKIOPDUPCUBEN-UHFFFAOYSA-N. The full InChI is InChI=1S/3C14H10N3.3Ag/c3*1-3-9-15-11(5-1)13-7-8-14(17-13)12-6-2-4-10-16-12;;;/h3*1-10H;;;/q3*-1;3*+1.

What are the key properties of Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine)?

Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine) has a molecular weight of 984.37 g/mol, XLogP of 8.30, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for Trisilver;tris(2-(5-pyridin-2-ylpyrrol-1-id-2-yl)pyridine) is sourced from PubChem (CID 139163297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 139163297 — identifiers, structure, computed properties (public domain)

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