Rapid Structure Determination of Molecular Solids Using Chemical Shifts Directed by Unambiguous Prior Constraints

[Image: see text] NMR-based crystallography approaches involving the combination of crystal structure prediction methods, ab initio calculated chemical shifts and solid-state NMR experiments are powerful methods for crystal structure determination of microcrystalline powders. However, currently stru...

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Bibliografske podrobnosti
izdano v:J Am Chem Soc
Main Authors: Hofstetter, Albert, Balodis, Martins, Paruzzo, Federico M., Widdifield, Cory M., Stevanato, Gabriele, Pinon, Arthur C., Bygrave, Peter J., Day, Graeme M., Emsley, Lyndon
Format: Artigo
Jezik:Inglês
Izdano: American Chemical Society 2019
Online dostop:https://ncbi.nlm.nih.gov/pmc/articles/PMC7540916/
https://ncbi.nlm.nih.gov/pubmed/31117663
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jacs.9b03908
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