Computational Exploration of Stereoelectronic Relationships in Manganese‐Catalyzed Hydrogenation Reactions

Goodfellow, A.S. orcid.org/0000-0002-0064-5007, Clarke, M.L. and Bühl, M. (2025) Computational Exploration of Stereoelectronic Relationships in Manganese‐Catalyzed Hydrogenation Reactions. Chemistry - A European Journal, 31 (34). e202501063. ISSN: 0947-6539

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Item Type: Article
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© 2025 The Author(s). This is an open access article under the terms of the Creative Commons Attribution License, which permits use, distribution and reproduction in any medium, provided the original work is properly cited.
Keywords: catalyst design, density functional theory, manganese, noncovalent interactions, stereoelectronic effects
Dates:
  • Accepted: 6 May 2025
  • Published (online): 19 May 2025
  • Published: 17 June 2025
Institution: The University of Leeds
Academic Units: The University of Leeds > Faculty of Engineering & Physical Sciences (Leeds) > School of Chemistry (Leeds)
Depositing User: Symplectic Publications
Date Deposited: 11 Jun 2025 10:20
Last Modified: 20 Aug 2025 13:11
Status: Published
Publisher: Wiley
Identification Number: 10.1002/chem.202501063
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