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Computational insight into a mechanistic overview of water exchange kinetics and thermodynamic stabilities of bis and tris-aquated complexes of lanthanides

A thorough investigation of Ln(3+) complexes with more than one inner-sphere water molecule is crucial for designing high relaxivity contrast agents (CAs) used in magnetic resonance imaging (MRI). This study accomplished a comparative stability analysis of two hexadentate (H(3)cbda and H(3)dpaa) and...

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Detalles Bibliográficos
Autores principales: Keot, Niharika, Sarma, Manabendra
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9816859/
https://www.ncbi.nlm.nih.gov/pubmed/36688060
http://dx.doi.org/10.1039/d2ra05810c

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