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Prediction of (19)F NMR Chemical Shifts for Fluorinated Aromatic Compounds
Scaling factors are reported for use in predicting (19)F NMR chemical shifts for fluorinated (hetero)aromatic compounds with relatively low levels of theory. Our recommended scaling factors were developed using a curated data set of >50 compounds, with 100 individual (19)F shifts spanning a range...
Gardado en:
| Publicado en: | J Org Chem |
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| Main Authors: | , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado: |
2018
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| Assuntos: | |
| Acceso en liña: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6025806/ https://ncbi.nlm.nih.gov/pubmed/29470063 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.joc.8b00104 |
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