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Structural Assessment of Hydrogen Bonds on Methylpentynol–Azide Clusters To Achieve Regiochemical Outcome of 1,3-Dipolar Cycloaddition Reactions Using Density Functional Theory
[Image: see text] This study was focused on the geometries and properties of the structural isomers obtained from a random walk of methylpentynol–HN(3) clusters. The theoretical aspects of hydrogen bonding effects on the discussed 1,3-dipolar cycloaddition (1,3-DC) reactions [between methylpentynol...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2020
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7098023/ https://www.ncbi.nlm.nih.gov/pubmed/32226877 http://dx.doi.org/10.1021/acsomega.9b04333 |