SbBr3

Antimony tribromide · Antimony(III) bromide

Antimony tribromide is a stable, insulating inorganic halide commonly utilized as a chemical reagent and precursor in material synthesis.

BrSb
Crystal structure of SbBr3 (orthorhombic, Pnma (No. 62))
Ground-state structure · Materials Project
Overview

About Antimony tribromide

Antimony tribromide is a stable, wide-gap insulating halide compound. Its structural versatility is evidenced by the numerous crystalline forms documented in research databases, highlighting its significance in solid-state chemistry. The compound serves as a critical reagent in various chemical processes, particularly in the synthesis of specialized inorganic materials. Its insulating nature and stability make it a subject of interest for fundamental studies in halide chemistry.

At a glance

Key Properties

Cross-validated computational properties for Antimony tribromide, aggregated across 3 databases.

Band Gap

2.73–3.13 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

34
3 databases, 11 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for SbBr3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Pnma (No. 62)orthorhombic3.120.0000-3.2694.14
P212121 (No. 19)orthorhombic3.130.0059-3.2634.08
Pnma (No. 62)orthorhombic2.730.0062-3.2624.08
Amm2 (No. 38)
Pnma (No. 62)
Pnma (No. 62)Orthorhombic3.85
Pnma (No. 62)Orthorhombic3.79
P1 (No. 1)Triclinic4.30
P1 (No. 1)Triclinic3.36
Pm (No. 6)Monoclinic5.61
Cm (No. 8)Monoclinic3.15
P21/m (No. 11)Monoclinic5.13
Uses

Applications

Where Antimony tribromide is used.

Chemical synthesisFlame retardant precursorCatalysis in organic reactions
Reference

Frequently Asked Questions

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

What is SbBr3?

Antimony tribromide is a stable, insulating inorganic halide commonly utilized as a chemical reagent and precursor in material synthesis.

More questions
What is SbBr3 used for?
Antimony tribromide (SbBr3) is used in chemical synthesis, flame retardant precursor, and catalysis in organic reactions.
What is the band gap of SbBr3?
Antimony tribromide (SbBr3) has a DFT-computed band gap of 2.73–3.13 eV across 34 reported structures.
Is SbBr3 a metal, semiconductor, or insulator?
With a wide band gap up to 3.13 eV it is an insulator / wide-band-gap material.
Is SbBr3 thermodynamically stable?
Yes — Antimony tribromide (SbBr3) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of SbBr3?
The lowest-energy reported polymorph of Antimony tribromide (SbBr3) is orthorhombic symmetry, space group Pnma (No. 62).
What is the density of SbBr3?
The computed density of the ground-state structure of Antimony tribromide (SbBr3) is 4.14 g/cm³.
How many polymorphs of SbBr3 are known?
34 structures of SbBr3 are reported across 3 databases, spanning 11 distinct space groups.
What elements does SbBr3 contain?
Antimony tribromide (SbBr3) contains Br and Sb (2 elements).
Where does the data for SbBr3 come from?
SbBr3 data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

As a distinct halide compound, Antimony tribromide occupies a unique position in inorganic chemistry, serving as a foundational material for studying antimony-based bonding environments and structural phase transitions.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
  • mpaloe — Data from mpaloe.

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