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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...

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Detalles Bibliográficos
Autores principales: Lam, Jonathan, Lewis, Richard J., Goodman, Jonathan M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2023
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

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