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Molecular Engineering to Tune Functionality: The Case of Cl-Substituted [Fe(terpy)(2)](2+)

[Image: see text] The properties of transition-metal complexes and their chemical dynamics can be effectively modified with ligand substitutions, and theory can be a great aid to such molecular engineering. In this paper, we first theoretically explored how substitution with a Cl atom at different p...

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Detalles Bibliográficos
Autores principales:	Papp, Mariann, Keszthelyi, Tamás, Vancza, Andor, Bajnóczi, Éva G., Kováts, Éva, Németh, Zoltán, Bogdán, Csilla, Bazsó, Gábor, Rozgonyi, Tamás, Vankó, György
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2023
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10131222/ https://www.ncbi.nlm.nih.gov/pubmed/37039430 http://dx.doi.org/10.1021/acs.inorgchem.3c00271

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