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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...
Autores principales: | Keot, Niharika, Sarma, Manabendra |
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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/PMC9816859/ https://www.ncbi.nlm.nih.gov/pubmed/36688060 http://dx.doi.org/10.1039/d2ra05810c |
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