BiBr3

Bismuth tribromide · Bismuth(III) bromide

Bismuth tribromide is a stable, semiconducting bismuth halide widely used as a reagent and catalyst in chemical synthesis.

BiBr
Crystal structure of BiBr3
Ground-state structure · Materials Project
Overview

About Bismuth tribromide

Bismuth tribromide is a stable inorganic halide that exhibits semiconducting electronic properties. Its structural versatility is evidenced by the extensive collection of reported crystal structures, highlighting its significance in solid-state chemistry and materials research.

Due to its unique chemical reactivity, this compound serves as a valuable reagent in various synthetic pathways. It is frequently employed in laboratory settings to facilitate complex transformations, leveraging the distinct electronic character of the bismuth-bromine bond.

At a glance

Key Properties

Cross-validated computational properties for Bismuth tribromide, aggregated across 4 databases.

Band Gap

2.52–2.88 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
3 DFT sources

Structures

40
4 databases, 9 space groups
Uses

Applications

Where Bismuth tribromide is used.

Organic synthesis catalystChemical reagentPrecursor for bismuth-based materials
Reference

Frequently Asked Questions

Common questions about Bismuth tribromide, answered from cross-validated data.

What is BiBr3?

Bismuth tribromide is a stable, semiconducting bismuth halide widely used as a reagent and catalyst in chemical synthesis.

More questions
What is BiBr3 used for?
Bismuth tribromide (BiBr3) is used in organic synthesis catalyst, chemical reagent, and precursor for bismuth-based materials.
What is the band gap of BiBr3?
Bismuth tribromide (BiBr3) has a DFT-computed band gap of 2.52–2.88 eV across 40 reported structures.
Is BiBr3 a metal, semiconductor, or insulator?
With a band gap up to 2.88 eV it is a semiconductor.
Is BiBr3 thermodynamically stable?
Yes — Bismuth tribromide (BiBr3) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of BiBr3 are known?
40 structures of BiBr3 are reported across 4 databases, spanning 9 distinct space groups.
What elements does BiBr3 contain?
Bismuth tribromide (BiBr3) contains Bi and Br (2 elements).
Where does the data for BiBr3 come from?
BiBr3 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a prominent member of the bismuth halide family, this compound is recognized for its thermodynamic stability on the convex hull. It represents a foundational material for understanding the structural and electronic trends within heavy metal halide systems.

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

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