SNCl

SNCl is a semiconducting sulfur-nitrogen-chlorine compound that exists as a metastable structure.

ClNS
Crystal structure of SNCl
Ground-state structure · Materials Project
Overview

About SNCl

SNCl is a complex inorganic compound composed of sulfur, nitrogen, and chlorine. As a semiconducting material, it represents a unique intersection of chalcogen and pnictogen chemistry, drawing interest for its distinct electronic properties within the broader landscape of synthetic chemical systems. The compound is characterized by a notable degree of structural diversity, with multiple reported configurations across various databases. Its position above the thermodynamic hull suggests that it is a metastable species, requiring specific synthetic conditions to stabilize its atomic arrangement.

At a glance

Key Properties

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

Band Gap

2.70 eV
Range across DFT structures

Energy Above Hull

0.266 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

8
3 databases, 5 space groups
Reference

Frequently Asked Questions

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

What is SNCl?

SNCl is a semiconducting sulfur-nitrogen-chlorine compound that exists as a metastable structure.

More questions
What is the band gap of SNCl?
SNCl has a DFT-computed band gap of 2.70 eV across 8 reported structures.
Is SNCl a metal, semiconductor, or insulator?
With a band gap up to 2.70 eV it is a semiconductor.
Is SNCl thermodynamically stable?
SNCl has a lowest energy above hull of 0.266 eV/atom (above hull).
How many polymorphs of SNCl are known?
8 structures of SNCl are reported across 3 databases, spanning 5 distinct space groups.
What elements does SNCl contain?
SNCl contains Cl, N, and S (3 elements).
Where does the data for SNCl come from?
SNCl data is cross-referenced from latticegraph.
Comparison

How It Compares

As a singular entry in this chemical space, SNCl serves as a focal point for understanding the interplay between electronegative halogens and sulfur-nitrogen frameworks. Its semiconducting nature and metastable status distinguish it as a specialized subject for fundamental studies in inorganic synthesis and structural evolution.

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

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