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Interpreting vibrational circular dichroism spectra: the Cai•factor for absolute configuration with confidence
Vibrational circular dichroism (VCD) spectroscopy can generate the data required for the assignment of absolute configuration, but the spectra are hard to interpret. We have recorded VCD data for thirty pairs of small organic compounds and we use this database to validate a method for the automated...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Springer International Publishing
2023
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10031863/ https://www.ncbi.nlm.nih.gov/pubmed/36945031 http://dx.doi.org/10.1186/s13321-023-00706-y |