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Computational Study of Photodegradation Process and Conversion Products of the Antidepressant Citalopram in Water

Citalopram (CIT) is a commonly prescribed medication for depression. However, the photodegradation mechanism of CIT has not yet been fully analyzed. Therefore, the photodegradation process of CIT in water is studied by density functional theory and time-dependent density functional theory. The calcu...

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Detalles Bibliográficos
Autores principales: Shen, Yifan, Wang, Se, Lu, Ying, Chen, Kai, Luo, Li, Hao, Ce
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10304023/
https://www.ncbi.nlm.nih.gov/pubmed/37375177
http://dx.doi.org/10.3390/molecules28124620