iridium(3+) tritetrafluoroborate

B3F12Ir — CID 18673244

About iridium(3+) tritetrafluoroborate

iridium(3+) tritetrafluoroborate (PubChem CID 18673244) has the molecular formula B3F12Ir and a molecular weight of 452.63 g/mol. Its IUPAC name is iridium(3+) tritetrafluoroborate.

Molecular Properties

• Compound Name: iridium(3+) tritetrafluoroborate
• PubChem CID: 18673244
• Molecular Formula: B3F12Ir
• Molecular Weight: 452.63 g/mol
• Exact Mass: 453.97
• IUPAC Name: iridium(3+) tritetrafluoroborate
• SMILES: F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F.[Ir+3]
• InChI: InChI=1S/3BF4.Ir/c3*2-1(3,4)5;/q3*-1;+3
• InChIKey: AWKBPOWEWQEDFE-UHFFFAOYSA-N
• XLogP: 3.90
• TPSA: 0.00 Ų
• Heavy Atoms: 16
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	452.63
LogP ≤ 5	3.90
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of iridium(3+) tritetrafluoroborate?

The IUPAC name of iridium(3+) tritetrafluoroborate (CID 18673244) is iridium(3+) tritetrafluoroborate.

What is the SMILES notation for iridium(3+) tritetrafluoroborate?

The canonical SMILES for iridium(3+) tritetrafluoroborate is F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F.[Ir+3].

What is the InChIKey of iridium(3+) tritetrafluoroborate?

The InChIKey is AWKBPOWEWQEDFE-UHFFFAOYSA-N. The full InChI is InChI=1S/3BF4.Ir/c3*2-1(3,4)5;/q3*-1;+3.

What are the key properties of iridium(3+) tritetrafluoroborate?

iridium(3+) tritetrafluoroborate has a molecular weight of 452.63 g/mol, XLogP of 3.90, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for iridium(3+) tritetrafluoroborate is sourced from PubChem (CID 18673244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).