Disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate

C₃₀H₄₈Ag₂F₁₂N₈P₂ — CID 139197470

About Disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate

Disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate (PubChem CID 139197470) has the molecular formula C₃₀H₄₈Ag₂F₁₂N₈P₂ and a molecular weight of 1026.43 g/mol. Its IUPAC name is disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate.

Molecular Properties

• Compound Name: Disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate
• PubChem CID: 139197470
• Molecular Formula: C₃₀H₄₈Ag₂F₁₂N₈P₂
• Molecular Weight: 1026.43 g/mol
• Exact Mass: 1024.14
• IUPAC Name: disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate
• SMILES: CC[n+]1[c-]n(CCCCCn2[c-][n+](CC)cc2)cc1.CC[n+]1[c-]n(CCCCCn2[c-][n+](CC)cc2)cc1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Ag+].[Ag+]
• InChI: InChI=1S/2C15H24N4.2Ag.2F6P/c2*1-3-16-10-12-18(14-16)8-6-5-7-9-19-13-11-17(4-2)15-19;;;2*1-7(2,3,4,5)6/h2*10-13H,3-9H2,1-2H3;;;;/q;;2*+1;2*-1
• InChIKey: GQKRXGHOWOUVEZ-UHFFFAOYSA-N
• XLogP: 9.51
• TPSA: 35.24 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 16
• Heavy Atoms: 54
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1026.43
LogP ≤ 5	9.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of Disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate?

The IUPAC name of Disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate (CID 139197470) is disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate.

What is the SMILES notation for Disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate?

The canonical SMILES for Disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate is CC[n+]1[c-]n(CCCCCn2[c-][n+](CC)cc2)cc1.CC[n+]1[c-]n(CCCCCn2[c-][n+](CC)cc2)cc1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Ag+].[Ag+].

What is the InChIKey of Disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate?

The InChIKey is GQKRXGHOWOUVEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H24N4.2Ag.2F6P/c2*1-3-16-10-12-18(14-16)8-6-5-7-9-19-13-11-17(4-2)15-19;;;2*1-7(2,3,4,5)6/h2*10-13H,3-9H2,1-2H3;;;;/q;;2*+1;2*-1.

What are the key properties of Disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate?

Disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate has a molecular weight of 1026.43 g/mol, XLogP of 9.51, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for Disilver;bis(1-ethyl-3-[5-(3-ethyl-2H-imidazol-3-ium-2-id-1-yl)pentyl]-2H-imidazol-1-ium-2-ide);dihexafluorophosphate is sourced from PubChem (CID 139197470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 139197470 — identifiers, structure, computed properties (public domain)

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