A density functional theory analysis of the C –H activation reactivity of iron(IV)-oxo complexes with an ‘O’ substituted tetramethylcyclam macrocycle

Dalton Trans., 2024, Advance Article DOI: 10.1039/D4DT00063C, PaperLovleen Kaur, Debasish Mandal As equatorial nitrogen atoms are replaced by oxygen atoms, [Fe(IV)OTMC] complexes become more reactive in C –H activation. The reaction follows exchange-enhanced mediated two-state reactivity patterns. Reactivity is dominated by electron acceptor orbital energy, which decreases with O-enrichment. To cite this article before page numbers are assigned, use the DOI form of citation above. The content of this RSS Feed (c) The Royal Society of Chemistry

http://pubs.rsc.org/en/Content/ArticleLanding/2024/DT/D4DT00063C

Source: RSC - Dalton Trans. latest articles - April 10, 2024 Category: Chemistry Authors: Lovleen Kaur Source Type: research

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