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A substrate descriptor based approach for the prediction and understanding of the regioselectivity in caged catalyzed hydroformylation
The use of data driven tools to predict the selectivity of homogeneous catalysts has received considerable attention in the past years. In these studies often the catalyst structure is varied, but the use of substrate descriptors to rationalize the catalytic outcome is relatively unexplored. To stud...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2023
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10416704/ https://www.ncbi.nlm.nih.gov/pubmed/37139675 http://dx.doi.org/10.1039/d3fd00023k |