Front Cover: Ruthenium‐Catalyzed CH Alkenylation of Trypanocidal Naphthoquinones: A Mechanistic Benchmarking Study (ChemistryOpen 2/2026)
Abstract
The Front Cover image highlights a computational study of the Ru(II)-catalyzed C–H alkenylation of menadione with ethenesulfonyl fluoride, enabling SuFEx functionalization of quinones. Density functional benchmarking against DLPNO-CCSD(T) establishes a robust mechanistic picture and supports the rational design of naphthoquinone derivatives targeting Trypanosoma cruzi. More details are available in the Research Article by Felipe Fantuzzi and co-workers (DOI: 10.1002/open.202500465).
Fields of Study & Subjects
Catalytic C–H Functionalization Methods
Organometallic Complex Synthesis and Catalysis
Catalytic Cross-Coupling Reactions
Publication details
- Journal / source
- ChemistryOpen
- Volume
- 15
- Issue
- 2
- Publication date
- 1 February 2026
- Language
- EN