UI4

uranium tetraiodide

Uranium tetraiodide is a crystalline inorganic compound composed of uranium and iodine. It is primarily utilized as a chemical intermediate in specialized research settings for the synthesis of organouranium complexes.

IU
Crystal structure of UI4 (monoclinic, C2/c (No. 15))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for uranium tetraiodide, aggregated across 3 databases.

Band Gap

0.17–0.27 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

10
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for UI4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
C2/c (No. 15)monoclinic0.270.0000-4.6285.17
C2/c (No. 15)monoclinic0.170.0501-4.5773.72
C2/c (No. 15)
C2/c (No. 15)
C2/c (No. 15)Monoclinic4.80
C2/c (No. 15)Monoclinic3.72
C2/c (No. 15)Monoclinic3.72
C2/c (No. 15)Monoclinic3.72
C2/c (No. 15)Monoclinic4.83
C2/c (No. 15)Monoclinic4.85
Uses

Applications

Where uranium tetraiodide is used.

chemical synthesisorganometallic research
Reference

Frequently Asked Questions

Common questions about uranium tetraiodide, answered from cross-validated data.

What is UI4?

Uranium tetraiodide is a crystalline inorganic compound composed of uranium and iodine. It is primarily utilized as a chemical intermediate in specialized research settings for the synthesis of organouranium complexes.

More questions
What is UI4 used for?
uranium tetraiodide (UI4) is used in chemical synthesis and organometallic research.
What is the band gap of UI4?
uranium tetraiodide (UI4) has a DFT-computed band gap of 0.17–0.27 eV across 10 reported structures.
Is UI4 a metal, semiconductor, or insulator?
With a band gap up to 0.27 eV it is a semiconductor.
Is UI4 thermodynamically stable?
Yes — uranium tetraiodide (UI4) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of UI4?
The lowest-energy reported polymorph of uranium tetraiodide (UI4) is monoclinic symmetry, space group C2/c (No. 15).
What is the density of UI4?
The computed density of the ground-state structure of uranium tetraiodide (UI4) is 5.17 g/cm³.
How many polymorphs of UI4 are known?
10 structures of UI4 are reported across 3 databases, spanning 1 distinct space group.
What elements does UI4 contain?
uranium tetraiodide (UI4) contains I and U (2 elements).
Where does the data for UI4 come from?
UI4 data is cross-referenced from materials_project, jarvis, mpaloe.
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.

Analyze UI4 in the Lattice Graph platform

Polymorph comparison, confidence scoring, supply-chain risk, and patent monitoring — across 53 integrated data sources.

Explore the Platform →