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Updated: May 8, 2026

Determination of the Photoisomerization Quantum Yield of a Hydrazone Photoswitch
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Determination of the Photoisomerization Quantum Yield of a Hydrazone Photoswitch

Published on: February 7, 2022

Halogen bond-driven azo-hydrazone tautomerisation: a computational study

Antti Siiskonen1, Arri Priimagi2

  • 1Faculty of Engineering and Natural Sciences, Smart Photonic Materials, Tampere University, Korkeakoulunkatu 3, Tampere, 33720, Finland.

Journal of Molecular Modeling
|May 7, 2026
PubMed
Summary

Halogen bonding influences azo-hydrazone tautomerization in azobenzenes, potentially inverting tautomeric preference and enabling tunable sensing applications. This study explores halogen bonding effects on hydroxyazobenzenes and related compounds.

Keywords:
AzobenzeneDensity functional theoryHalogen bondingTautomerisation

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