C6I2N2
C6I2N2 is a semiconducting material composed of carbon, iodine, and nitrogen that exhibits metastable thermodynamic characteristics.

About C6I2N2
C6I2N2 is a complex organic-inorganic hybrid material characterized by its semiconducting electronic nature. Its composition, involving carbon, iodine, and nitrogen, suggests a unique molecular arrangement that distinguishes it from simpler binary systems. Due to its position relative to the thermodynamic ground state, this compound is considered metastable. It represents an intriguing subject for synthetic chemistry and materials research, where understanding its structural behavior is essential for potential functional applications.
Key Properties
Cross-validated computational properties for C6I2N2, 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.
Frequently Asked Questions
Common questions about C6I2N2, answered from cross-validated data.
What is C6I2N2?
C6I2N2 is a semiconducting material composed of carbon, iodine, and nitrogen that exhibits metastable thermodynamic characteristics.
What is the band gap of C6I2N2?
Is C6I2N2 a metal, semiconductor, or insulator?
Is C6I2N2 thermodynamically stable?
How many polymorphs of C6I2N2 are known?
What elements does C6I2N2 contain?
Where does the data for C6I2N2 come from?
How It Compares
As a unique compound within its chemical space, C6I2N2 serves as a specialized example of carbon-based semiconducting materials, providing a distinct structural framework that differs from more conventional, highly stable carbon-nitrogen or carbon-iodine compounds.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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