Cl4N6S4V2

Cl4N6S4V2 is a metastable, semiconducting inorganic compound composed of vanadium, chlorine, nitrogen, and sulfur.

ClNSV
Crystal structure of Cl4N6S4V2
Ground-state structure · Materials Project
Overview

About Cl4N6S4V2

Cl4N6S4V2 is a complex inorganic compound containing vanadium, sulfur, nitrogen, and chlorine. It exhibits semiconducting electronic behavior, positioning it as an interesting subject for fundamental research into transition metal-sulfur-nitrogen frameworks.

Due to its position above the thermodynamic hull, this material is considered metastable. It serves as a specialized example of how complex coordination environments can stabilize unique atomic arrangements, even when they are not the most stable configuration at standard conditions.

At a glance

Key Properties

Cross-validated computational properties for Cl4N6S4V2, aggregated across 3 databases.

Band Gap

0.81–0.86 eV
Range across DFT structures

Energy Above Hull

0.271 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

4
3 databases, 1 space group
Reference

Frequently Asked Questions

Common questions about Cl4N6S4V2, answered from cross-validated data.

What is Cl4N6S4V2?

Cl4N6S4V2 is a metastable, semiconducting inorganic compound composed of vanadium, chlorine, nitrogen, and sulfur.

More questions
What is the band gap of Cl4N6S4V2?
Cl4N6S4V2 has a DFT-computed band gap of 0.81–0.86 eV across 4 reported structures.
Is Cl4N6S4V2 a metal, semiconductor, or insulator?
With a band gap up to 0.86 eV it is a semiconductor.
Is Cl4N6S4V2 thermodynamically stable?
Cl4N6S4V2 has a lowest energy above hull of 0.271 eV/atom (above hull).
How many polymorphs of Cl4N6S4V2 are known?
4 structures of Cl4N6S4V2 are reported across 3 databases, spanning 1 distinct space group.
What elements does Cl4N6S4V2 contain?
Cl4N6S4V2 contains Cl, N, S, and V (4 elements).
Where does the data for Cl4N6S4V2 come from?
Cl4N6S4V2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique inorganic complex, Cl4N6S4V2 represents a distinct structural motif within its chemical family. Unlike more common, highly stable binary materials, this compound highlights the diversity of synthetic pathways available for incorporating vanadium into nitrogen-sulfur networks.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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