CS2

carbon disulfide · carbon bisulfide

Carbon disulfide is a highly volatile and reactive insulating liquid widely used as a chemical solvent and precursor in industrial manufacturing.

CS
Crystal structure of CS2
Ground-state structure · Materials Project
Overview

About carbon disulfide

Carbon disulfide is a simple inorganic compound characterized by its insulating electronic nature. Despite its structural simplicity, it exhibits significant polymorphism, with numerous reported arrangements documented across materials databases. Its chemical behavior is marked by high volatility and reactivity, which defines its utility in synthetic chemistry. Because it sits above the thermodynamic hull, it is considered a metastable species that requires careful handling and specific conditions for synthesis and storage. Its role as a solvent and chemical intermediate remains vital in various industrial processes, leveraging its unique ability to dissolve a wide range of organic and inorganic substances.

At a glance

Key Properties

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

Band Gap

3.43 eV
Range across DFT structures

Energy Above Hull

0.226 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

43
3 databases, 16 space groups
Uses

Applications

Where carbon disulfide is used.

Manufacturing of rayonProduction of cellophaneChemical solventPesticide intermediateRubber vulcanization
Intellectual Property

Patent Landscape

3 patents reference CS2 or close compositional variants.

PatentTitleAssigneeGranted
6444185Process for recovering as sulfur the compounds H2S, SO2, COS and/or CS2 in a tail gas from a sulfur plant
4399112Process for the catalytic incineration of residual gases containing a low content of at least one sulfur compo
4735788Process of removing of COS and CS.sub.2 compounds contained in an industrial gas
Reference

Frequently Asked Questions

Common questions about carbon disulfide, answered from cross-validated data.

What is CS2?

Carbon disulfide is a highly volatile and reactive insulating liquid widely used as a chemical solvent and precursor in industrial manufacturing.

More questions
What is CS2 used for?
carbon disulfide (CS2) is used in manufacturing of rayon, production of cellophane, chemical solvent, pesticide intermediate, and rubber vulcanization.
What is the band gap of CS2?
carbon disulfide (CS2) has a DFT-computed band gap of 3.43 eV across 43 reported structures.
Is CS2 a metal, semiconductor, or insulator?
With a wide band gap up to 3.43 eV it is an insulator / wide-band-gap material.
Is CS2 thermodynamically stable?
carbon disulfide (CS2) has a lowest energy above hull of 0.226 eV/atom (above hull).
How many polymorphs of CS2 are known?
43 structures of CS2 are reported across 3 databases, spanning 16 distinct space groups.
What elements does CS2 contain?
carbon disulfide (CS2) contains C and S (2 elements).
Where does the data for CS2 come from?
CS2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a standalone compound in its chemical category, carbon disulfide serves as a foundational example of a volatile, insulating carbon-sulfur system. Unlike more complex or stable solid-state materials, its identity is defined by its high reactivity and the relative ease with which it transitions between different structural states, highlighting the challenges of maintaining stability in such high-energy molecular configurations.

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

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