Quantitative Interpretation of Diffusion-Ordered NMR Spectra: Can We Rationalize Small Molecule Diffusion Coefficients?

被引:194
作者
Evans, Robert [1 ]
Deng, Zhaoxia [1 ]
Rogerson, Alexandria K. [1 ]
McLachlan, Andy S. [3 ]
Richards, Jeff J. [4 ]
Nilsson, Mathias [1 ,2 ]
Morris, Gareth A. [1 ]
机构
[1] Univ Manchester, Sch Chem, Manchester M13 9PL, Lancs, England
[2] Univ Copenhagen, Dept Food Sci, DK-1958 Frederiksberg C, Denmark
[3] Adv Chem Dev Inc, Toronto, ON, Canada
[4] GlaxoSmithKline, Brentford TW89GS, England
基金
英国工程与自然科学研究理事会;
关键词
analytical methods; diffusion; diffusion-ordered spectroscopy; molecular weight; NMR spectroscopy; COMBINATORIAL CHEMISTRY; SPECTROSCOPY;
D O I
10.1002/anie.201207403
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Appealingly simple: A new method is described that allows the diffusion coefficient of a small molecule to be estimated given only the molecular weight and the viscosity of the solvent used. This method makes possible the quantitative interpretation of the diffusion domain of diffusion-ordered NMR spectra (see picture). © 2013 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.
引用
收藏
页码:3199 / 3202
页数:4
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