SCl2

Sulfur dichloride · Sulfur(II) chloride

Sulfur dichloride is a reactive, metastable chemical compound primarily used as a versatile reagent in the synthesis of sulfur-containing organic materials.

ClS
Crystal structure of SCl2
Ground-state structure · Materials Project
Overview

About Sulfur dichloride

Sulfur dichloride is a reactive, metastable molecular compound consisting of sulfur and chlorine. Its semiconducting electronic character and chemical reactivity make it a critical reagent for introducing sulfur into various organic frameworks. Due to its high chemical utility, it is extensively documented in structural databases. It serves as a foundational building block in the production of vulcanizing agents and various sulfur-containing specialty chemicals.

At a glance

Key Properties

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

Band Gap

2.09 eV
Range across DFT structures

Energy Above Hull

0.053 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

46
3 databases, 14 space groups
Uses

Applications

Where Sulfur dichloride is used.

Vulcanization of rubberSynthesis of sulfur-containing organic compoundsProduction of chemical intermediatesPreparation of sulfur mustard derivatives
Reference

Frequently Asked Questions

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

What is SCl2?

Sulfur dichloride is a reactive, metastable chemical compound primarily used as a versatile reagent in the synthesis of sulfur-containing organic materials.

More questions
What is SCl2 used for?
Sulfur dichloride (SCl2) is used in vulcanization of rubber, synthesis of sulfur-containing organic compounds, production of chemical intermediates, and preparation of sulfur mustard derivatives.
What is the band gap of SCl2?
Sulfur dichloride (SCl2) has a DFT-computed band gap of 2.09 eV across 46 reported structures.
Is SCl2 a metal, semiconductor, or insulator?
With a band gap up to 2.09 eV it is a semiconductor.
Is SCl2 thermodynamically stable?
Sulfur dichloride (SCl2) has a lowest energy above hull of 0.053 eV/atom (metastable).
How many polymorphs of SCl2 are known?
46 structures of SCl2 are reported across 3 databases, spanning 14 distinct space groups.
What elements does SCl2 contain?
Sulfur dichloride (SCl2) contains Cl and S (2 elements).
Where does the data for SCl2 come from?
SCl2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a primary sulfur-chlorine species, this compound serves as a fundamental precursor in industrial chemistry, acting as a key building block for more complex sulfur-based molecules where high reactivity is required for efficient synthesis.

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

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