H24Cl12N12O4Ru4
H24Cl12N12O4Ru4 is a semiconducting ruthenium-based coordination complex that exhibits thermodynamic stability suitable for experimental synthesis.
About H24Cl12N12O4Ru4
H24Cl12N12O4Ru4 is a complex ruthenium-based inorganic compound characterized by its semiconducting electronic nature. Its structural composition suggests a specific coordination environment that facilitates its role in specialized chemical research and potential material development.
As a near-hull stable compound, it is considered a viable candidate for experimental synthesis. Its unique arrangement of ruthenium, chlorine, nitrogen, and oxygen atoms provides a distinct platform for exploring electronic properties within the broader landscape of ruthenium-based coordination chemistry.
Key Properties
Cross-validated computational properties for H24Cl12N12O4Ru4, 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.
Reported Structures
Lowest-energy structures reported for H24Cl12N12O4Ru4, ranked by energy above hull.
| Space GroupSymmetry classification of the crystal arrangement. The number is the international space-group index. | Crystal SystemBroad lattice family, such as cubic, tetragonal, monoclinic, or triclinic, derived from unit-cell symmetry. | Band Gap (eV)Electronic gap calculated for this specific reported structure, measured in electronvolts. | E above hull (eV/atom)Thermodynamic distance from the convex hull for this structure, normalized per atom. Lower is generally more stable. | E/atom (eV)Computed total energy normalized per atom. Use energy above hull, not this value alone, when comparing stability. | Density (g/cm³)Mass per relaxed crystal volume, reported in grams per cubic centimeter. |
|---|---|---|---|---|---|
| P21/c (No. 14) | monoclinic | 1.88 | 0.0092 | -5.441 | 2.29 |
| — | — | — | — | — | 2.31 |
| No. 0 | unknown | — | — | — | 0.51 |
Applications
Where H24Cl12N12O4Ru4 is used.
Frequently Asked Questions
Common questions about H24Cl12N12O4Ru4, answered from cross-validated data.
What is H24Cl12N12O4Ru4?
H24Cl12N12O4Ru4 is a semiconducting ruthenium-based coordination complex that exhibits thermodynamic stability suitable for experimental synthesis.
What is H24Cl12N12O4Ru4 used for?
What is the band gap of H24Cl12N12O4Ru4?
Is H24Cl12N12O4Ru4 a metal, semiconductor, or insulator?
Is H24Cl12N12O4Ru4 thermodynamically stable?
What is the crystal structure of H24Cl12N12O4Ru4?
What is the density of H24Cl12N12O4Ru4?
How many polymorphs of H24Cl12N12O4Ru4 are known?
What elements does H24Cl12N12O4Ru4 contain?
Where does the data for H24Cl12N12O4Ru4 come from?
How It Compares
As a singular entry in its current classification, H24Cl12N12O4Ru4 serves as a foundational reference point for future studies into ruthenium-nitrogen-halogen coordination complexes. Its stability profile differentiates it from more volatile or highly reactive analogues, positioning it as a stable target for structural characterization.
Data sources & attribution
- materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
- omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
- cod — Data from the Crystallography Open Database. Cite: Grazulis et al., Nucleic Acids Res. 40, D420 (2012).
Analyze H24Cl12N12O4Ru4 in the Lattice Graph platform
Polymorph comparison, confidence scoring, supply-chain risk, and patent monitoring — across 53 integrated data sources.
Explore the Platform →