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How solvent determines the molecular reactive conformation and the selectivity: Solvation spheres and energy
In solution, the solvent determines the molecular conformation and the chemical reaction viability and selectivity. When solvent-solute and solvent-solvent interactions present similar strengths, explicit salvation is the best way to describe a system. The problem to solve is how big the explicit sh...
Autores principales: | Hernández-Lima, Joseelyne, Ramírez-Gualito, Karla, Quiroz-García, Beatriz, Silva-Portillo, Ana Luisa, Carrillo-Nava, Ernesto, Cortés-Guzmán, Fernando |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Frontiers Media S.A.
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9557062/ https://www.ncbi.nlm.nih.gov/pubmed/36247683 http://dx.doi.org/10.3389/fchem.2022.1012769 |
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