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Mechanistic Investigations on the Photoisomerization Reactions of Five-Membered Ring Heterocyclic Molecules Containing Sulfur and Selenium Atoms
[Image: see text] The restricted active space self-consistent field method in the 26-electron/27-orbital active space and the 6-311(d) basis set has been used to investigate the mechanisms of the photochemical isomerization reactions concerning the model systems of 1,2,3-thiadiazole and 1,2,3-selena...
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2018
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6641236/ https://www.ncbi.nlm.nih.gov/pubmed/31458599 http://dx.doi.org/10.1021/acsomega.8b00016 |