SCl4

Sulfur tetrachloride · Tetrachlorosulfur

Sulfur tetrachloride is a stable, semiconducting inorganic compound used primarily as a chemical reagent.

ClS
Crystal structure of SCl4
Ground-state structure · Materials Project
Overview

About Sulfur tetrachloride

Sulfur tetrachloride is a binary inorganic compound composed of sulfur and chlorine. It exists as a thermodynamically stable phase on the convex hull, representing a well-defined chemical species within its structural family. Its electronic character is defined as semiconducting, which influences its behavior in various chemical environments.

Due to its specific bonding nature, this compound is primarily utilized in synthetic chemistry as a chlorinating agent. Its stability and structural diversity, evidenced by multiple reported configurations, make it a subject of interest for researchers studying sulfur-halogen interactions and their potential applications in specialized chemical synthesis.

At a glance

Key Properties

Cross-validated computational properties for Sulfur tetrachloride, aggregated across 2 databases.

Band Gap

2.76 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
1 DFT source

Structures

19
2 databases, 8 space groups
Uses

Applications

Where Sulfur tetrachloride is used.

Chlorinating agentChemical synthesis
Reference

Frequently Asked Questions

Common questions about Sulfur tetrachloride, answered from cross-validated data.

What is SCl4?

Sulfur tetrachloride is a stable, semiconducting inorganic compound used primarily as a chemical reagent.

More questions
What is SCl4 used for?
Sulfur tetrachloride (SCl4) is used in chlorinating agent and chemical synthesis.
What is the band gap of SCl4?
Sulfur tetrachloride (SCl4) has a DFT-computed band gap of 2.76 eV across 19 reported structures.
Is SCl4 a metal, semiconductor, or insulator?
With a band gap up to 2.76 eV it is a semiconductor.
Is SCl4 thermodynamically stable?
Yes — Sulfur tetrachloride (SCl4) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of SCl4 are known?
19 structures of SCl4 are reported across 2 databases, spanning 8 distinct space groups.
What elements does SCl4 contain?
Sulfur tetrachloride (SCl4) contains Cl and S (2 elements).
Where does the data for SCl4 come from?
SCl4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct sulfur-chlorine compound, sulfur tetrachloride occupies a specific niche in inorganic chemistry, serving as a reactive intermediate that highlights the versatility of sulfur in higher oxidation states.

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

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