Determination of the relative configuration of organic compounds using NMR and DG: A systematic approach for a model system
Determination of the relative configuration of organic compounds using NMR and DG: A systematic approach for a model system
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DOI：
10.1007/s008940050057
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发表时间：
1997-01-01
影响因子：
2.2
通讯作者：
Junker, J
中科院分区：
文献类型：
--
作者：
Kock, M;Junker, J
一般来说，天然产物或有机化合物的结构分配通常是通过x射线晶体学或化学合成来完成的。核磁共振波谱通常只在构型分配的背景下以定性的方式使用。本文将阐明一个系统的研究，结合使用核磁共振光谱和距离几何（DG）计算来确定有机模型化合物的相对构型。NMR/DG方法允许量化配置分配。
The assignment of the configuration of natural products or organic compounds in general is often carried out by X-ray crystallography or chemical synthesis. NMR spectroscopy is often used only in a qualitative way in the context of configuration assignment. This paper will illuminate a systematic investigation of the combined use of NMR spectroscopy and distance geometry (DG) calculations for the determination of the relative configuration of an organic model compound. The NMR/DG approach allows to quantify configurational assignments.