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Relativistic Effects on NMR Parameters of Halogen-Bonded Complexes
Relativistic effects are found to be important for the estimation of NMR parameters in halogen-bonded complexes, mainly when they involve the heavier elements, iodine and astatine. A detailed study of 60 binary complexes formed between dihalogen molecules (XY with X, Y = F, Cl, Br, I and At) and fou...
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| Publicado no: | Molecules |
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| Main Authors: | , , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
MDPI
2019
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6930553/ https://ncbi.nlm.nih.gov/pubmed/31810199 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules24234399 |
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