SnCO

This compound is a tin-based carbonyl species often studied in the context of organometallic chemistry and surface science. It is primarily utilized as a precursor or intermediate in specialized chemical synthesis and materials research.

Overview

Key Properties

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

Band Gap

0.02 eV
Range across DFT structures

Energy Above Hull

1.309 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

5
3 databases, 4 space groups
Crystallography

Reported Structures

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

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Iba2 (No. 45)orthorhombic0.021.3087-6.7314.42
Cm (No. 8)Monoclinic6.53
P21/m (No. 11)Monoclinic5.99
P21/m (No. 11)Monoclinic5.90
P-6m2 (No. 187)
Uses

Applications

Where SnCO is used.

Chemical synthesisMaterials science researchCatalysis studies
Reference

Frequently Asked Questions

Common questions about SnCO, answered from cross-validated data.

What is SnCO?

This compound is a tin-based carbonyl species often studied in the context of organometallic chemistry and surface science. It is primarily utilized as a precursor or intermediate in specialized chemical synthesis and materials research.

More questions
What is SnCO used for?
SnCO is used in chemical synthesis, materials science research, and catalysis studies.
What is the band gap of SnCO?
SnCO has a DFT-computed band gap of 0.02 eV across 5 reported structures.
Is SnCO a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is SnCO thermodynamically stable?
SnCO has a lowest energy above hull of 1.309 eV/atom (above hull).
What is the crystal structure of SnCO?
The lowest-energy reported polymorph of SnCO is orthorhombic symmetry, space group Iba2 (No. 45).
What is the density of SnCO?
The computed density of the ground-state structure of SnCO is 4.42 g/cm³.
How many polymorphs of SnCO are known?
5 structures of SnCO are reported across 3 databases, spanning 4 distinct space groups.
What elements does SnCO contain?
SnCO contains C, O, and Sn (3 elements).
Where does the data for SnCO come from?
SnCO data is cross-referenced from materials_project, mpaloe, jarvis.
Explore

Related Compounds

Other Transparent Conducting Oxides in the database.

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

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