Hg3Cl4O
Hg3Cl4O is a stable, semiconducting mercury oxychloride compound characterized by its well-defined structural framework.
About Hg3Cl4O
Hg3Cl4O is a distinct mercury-based oxychloride that exists as a thermodynamically stable phase on the convex hull. Its electronic character is defined by semiconducting behavior, making it an intriguing subject for research into complex halide-oxide systems.
Given the multiple reported structures across various databases, this compound serves as a key reference point for understanding mercury coordination chemistry. Its stability and electronic profile suggest potential utility in specialized optoelectronic or catalytic applications where mercury-based frameworks are required.
Key Properties
Cross-validated computational properties for Hg3Cl4O, aggregated across 3 databases.
Band GapEnergy needed to move an electron from the valence band to the conduction band. Lower or zero values tend to behave more metallic; larger gaps are more insulating or semiconducting.
Energy Above HullThermodynamic distance from the most stable set of competing phases. 0 eV/atom is on the convex hull; small positive values may still be experimentally accessible.
StabilityA plain-language summary of the best reported energy-above-hull result. It reflects whether the lowest-energy structure is on, near, or far from the stability hull.
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
Applications
Where Hg3Cl4O is used.
Frequently Asked Questions
Common questions about Hg3Cl4O, answered from cross-validated data.
What is Hg3Cl4O?
Hg3Cl4O is a stable, semiconducting mercury oxychloride compound characterized by its well-defined structural framework.
What is Hg3Cl4O used for?
What is the band gap of Hg3Cl4O?
Is Hg3Cl4O a metal, semiconductor, or insulator?
Is Hg3Cl4O thermodynamically stable?
How many polymorphs of Hg3Cl4O are known?
What elements does Hg3Cl4O contain?
Where does the data for Hg3Cl4O come from?
How It Compares
As a unique mercury oxychloride, this compound represents a specialized niche in inorganic chemistry, serving as a foundational example of stable mercury-halide-oxide architectures that warrant further investigation for their distinct electronic properties.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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