Na2SO3

Sodium sulfite · Sodium sulphite

Sodium sulfite is a white, water-soluble inorganic salt commonly used as a preservative and antioxidant in food processing and industrial water treatment.

NaOS
Crystal structure of Na2SO3 (trigonal, P-3 (No. 147))
Ground-state structure · Materials Project
Overview

About Sodium sulfite

Sodium sulfite is a versatile inorganic compound characterized by its wide-band-gap insulating electronic structure. It is recognized for its role as a chemical reducing agent, frequently utilized in water treatment and the pulp and paper industry to manage oxygen levels and bleaching processes.

While this compound is considered metastable, it remains a highly practical substance in various chemical synthesis pathways. Its ability to act as a scavenger for reactive species makes it a staple in laboratory and commercial settings where oxidative degradation must be strictly controlled.

At a glance

Key Properties

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

Band Gap

0.48–4.92 eV
Range across DFT structures

Energy Above Hull

0.062 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

7
3 databases, 3 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Na2SO3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P-3 (No. 147)trigonal4.920.0616-5.6312.56
C2221 (No. 20)orthorhombic0.480.6246-5.0682.09
Cmcm (No. 63)
P-3 (No. 147)
P-3 (No. 147)Trigonal2.56
P-3 (No. 147)Trigonal2.68
P-3 (No. 147)Trigonal2.60
Uses

Applications

Where Sodium sulfite is used.

Food preservativeWater treatmentPulp and paper bleachingPhotography chemicalTextile industry
Reference

Frequently Asked Questions

Common questions about Sodium sulfite, answered from cross-validated data.

What is Na2SO3?

Sodium sulfite is a white, water-soluble inorganic salt commonly used as a preservative and antioxidant in food processing and industrial water treatment.

More questions
What is Na2SO3 used for?
Sodium sulfite (Na2SO3) is used in food preservative, water treatment, pulp and paper bleaching, photography chemical, and textile industry.
What is the band gap of Na2SO3?
Sodium sulfite (Na2SO3) has a DFT-computed band gap of 0.48–4.92 eV across 7 reported structures.
Is Na2SO3 a metal, semiconductor, or insulator?
With a wide band gap up to 4.92 eV it is an insulator / wide-band-gap material.
Is Na2SO3 thermodynamically stable?
Sodium sulfite (Na2SO3) has a lowest energy above hull of 0.062 eV/atom (metastable).
What is the crystal structure of Na2SO3?
The lowest-energy reported polymorph of Sodium sulfite (Na2SO3) is trigonal symmetry, space group P-3 (No. 147).
What is the density of Na2SO3?
The computed density of the ground-state structure of Sodium sulfite (Na2SO3) is 2.56 g/cm³.
How many polymorphs of Na2SO3 are known?
7 structures of Na2SO3 are reported across 3 databases, spanning 3 distinct space groups.
What elements does Na2SO3 contain?
Sodium sulfite (Na2SO3) contains Na, O, and S (3 elements).
Where does the data for Na2SO3 come from?
Na2SO3 data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

As a standalone representative of its chemical class, sodium sulfite serves as a primary benchmark for sulfite-based chemistry, demonstrating the essential reactivity profile required for effective oxygen scavenging and industrial bleaching applications.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
  • mpaloe — Data from mpaloe.

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