IrBr3

Iridium(III) bromide · Iridium tribromide

Iridium(III) bromide is a stable, semiconducting iridium halide used primarily as a chemical precursor and catalyst component.

Crystal structure of IrBr3
Ground-state structure · Materials Project
Overview

About Iridium(III) bromide

Iridium(III) bromide is a thermodynamically stable compound that belongs to the platinum-group alloy catalyst class. Its semiconducting electronic nature makes it an interesting candidate for specialized chemical synthesis and materials research.

As a well-documented material with multiple reported structures, it serves as a reliable precursor in the development of advanced iridium-containing catalysts. Its stability ensures consistent performance in various chemical environments where iridium-based compounds are required.

At a glance

Key Properties

Cross-validated computational properties for Iridium(III) bromide, aggregated across 3 databases.

Band Gap

1.56 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

12
3 databases, 6 space groups
Uses

Applications

Where Iridium(III) bromide is used.

Chemical synthesis catalystPrecursor for iridium-based materialsLaboratory reagent
Reference

Frequently Asked Questions

Common questions about Iridium(III) bromide, answered from cross-validated data.

What is IrBr3?

Iridium(III) bromide is a stable, semiconducting iridium halide used primarily as a chemical precursor and catalyst component.

More questions
What is IrBr3 used for?
Iridium(III) bromide (IrBr3) is used in chemical synthesis catalyst, precursor for iridium-based materials, and laboratory reagent.
What is the band gap of IrBr3?
Iridium(III) bromide (IrBr3) has a DFT-computed band gap of 1.56 eV across 12 reported structures.
Is IrBr3 a metal, semiconductor, or insulator?
With a band gap up to 1.56 eV it is a semiconductor.
Is IrBr3 thermodynamically stable?
Yes — Iridium(III) bromide (IrBr3) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of IrBr3 are known?
12 structures of IrBr3 are reported across 3 databases, spanning 6 distinct space groups.
What elements does IrBr3 contain?
Iridium(III) bromide (IrBr3) contains Br and Ir (2 elements).
Where does the data for IrBr3 come from?
IrBr3 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Within the diverse group of platinum-group alloys and compounds, IrBr3 stands out for its halide-based composition compared to more metallic or intermetallic siblings like As2Ir or LaRh. While many members of this class focus on metallic bonding for high-temperature stability, IrBr3 utilizes its semiconducting properties to facilitate specific catalytic pathways that are distinct from its intermetallic counterparts.

Explore

Related Compounds

Other Platinum-Group Alloy Catalysts in the database.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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