Abstract
The supramolecular assemblies that form during chiral chromatographic resolution of enantiomers are diastereomeric. A variety of computational approaches are used to discern where and how chiral discrimination takes place on increasingly more complex chiral stationary phases (CSPs) beginning with simple brush-like CSPs, and continuing to macrocyclic cyclodextrins and chiral polymers like cellulose triacetate. In all cases computational chemistry provides detailed atomic level information not amenable to experimentation.
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References
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The computational methodology will appear in a forthcoming paper. A.G. Anderson and K.B. Lipkowitz, in preparation.
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Lipkowitz, K.B., Anderson, A.G. (1994). Computational Aspects in Supramolecular Chemistry: Chiral Discrimination in Chromatography. In: Wipff, G. (eds) Computational Approaches in Supramolecular Chemistry. NATO ASI Series, vol 426. Springer, Dordrecht. https://doi.org/10.1007/978-94-011-1058-7_13
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DOI: https://doi.org/10.1007/978-94-011-1058-7_13
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