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Halogen Bonding Involving CO and CS with Carbon as the Electron Donor
MP2/aug’-cc-pVTZ calculations have been carried out to investigate the halogen-bonded complexes formed when CO and CS act as electron-pair donors through C to ClF, ClNC, ClCl, ClOH, ClCN, ClCCH, and ClNH(2). CO forms only complexes stabilized by traditional halogen bonds, and all ClY molecules form...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
MDPI
2017
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6150174/ https://www.ncbi.nlm.nih.gov/pubmed/29137153 http://dx.doi.org/10.3390/molecules22111955 |