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Type I–IV Halogen⋯Halogen Interactions: A Comparative Theoretical Study in Halobenzene⋯Halobenzene Homodimers
In the current study, unexplored type IV halogen⋯halogen interaction was thoroughly elucidated, for the first time, and compared to the well-established types I–III interactions by means of the second-order Møller–Plesset (MP2) method. For this aim, the halobenzene⋯halobenzene homodimers (where halo...
Autores principales: | Ibrahim, Mahmoud A. A., Saeed, Rehab R. A., Shehata, Mohammed N. I., Ahmed, Muhammad Naeem, Shawky, Ahmed M., Khowdiary, Manal M., Elkaeed, Eslam B., Soliman, Mahmoud E. S., Moussa, Nayra A. M. |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8953242/ https://www.ncbi.nlm.nih.gov/pubmed/35328534 http://dx.doi.org/10.3390/ijms23063114 |
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