C2F10N2S4

C2F10N2S4 is a metastable, semiconducting compound composed of carbon, fluorine, nitrogen, and sulfur atoms.

CFNS
Crystal structure of C2F10N2S4 (triclinic, P-1 (No. 2))
Ground-state structure · Materials Project
Overview

About C2F10N2S4

C2F10N2S4 is a complex polyatomic compound containing carbon, fluorine, nitrogen, and sulfur. As a semiconducting material, it represents a specialized chemical architecture that is of interest for fundamental studies in molecular electronics and synthetic chemistry.

Due to its position above the thermodynamic hull, this compound is considered metastable. Its existence across multiple structural databases highlights its role as a subject of ongoing theoretical and experimental investigation into high-energy chemical systems.

At a glance

Key Properties

Cross-validated computational properties for C2F10N2S4, aggregated across 3 databases.

Band Gap

2.94 eV
Range across DFT structures

Energy Above Hull

0.387 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

3
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for C2F10N2S4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P-1 (No. 2)triclinic2.940.3873-5.1032.00
1.33
P-1 (No. 2)
Reference

Frequently Asked Questions

Common questions about C2F10N2S4, answered from cross-validated data.

What is C2F10N2S4?

C2F10N2S4 is a metastable, semiconducting compound composed of carbon, fluorine, nitrogen, and sulfur atoms.

More questions
What is the band gap of C2F10N2S4?
C2F10N2S4 has a DFT-computed band gap of 2.94 eV across 3 reported structures.
Is C2F10N2S4 a metal, semiconductor, or insulator?
With a band gap up to 2.94 eV it is a semiconductor.
Is C2F10N2S4 thermodynamically stable?
C2F10N2S4 has a lowest energy above hull of 0.387 eV/atom (above hull).
What is the crystal structure of C2F10N2S4?
The lowest-energy reported polymorph of C2F10N2S4 is triclinic symmetry, space group P-1 (No. 2).
What is the density of C2F10N2S4?
The computed density of the ground-state structure of C2F10N2S4 is 2.00 g/cm³.
How many polymorphs of C2F10N2S4 are known?
3 structures of C2F10N2S4 are reported across 3 databases, spanning 1 distinct space group.
What elements does C2F10N2S4 contain?
C2F10N2S4 contains C, F, N, and S (4 elements).
Where does the data for C2F10N2S4 come from?
C2F10N2S4 data is cross-referenced from materials_project, omat24, aflow.
Comparison

How It Compares

As a unique chemical entity, C2F10N2S4 occupies a niche position in materials science where its specific stoichiometry and electronic properties distinguish it from more conventional, stable inorganic frameworks.

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).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).

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