Application of Computational Chemistry in Identification for Chiral Compounds
Ren Jie; Zhu Hua-Jie
2009-10-10
发表期刊CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE
卷号30期号:10页码:1907-1918
摘要Study on chiral compounds, especially in natural chemistry, becomes more and more important. One of the major problems that are met in the study is configuration identification. When no crystalline is obtained, or in other case, such as that too much complex correlations in 2D NMR are recorded, computational methods provide a useful tool in the study. Currently, the widely used methods include calculation of optical rotations, or determinant of matrix. By comparing these data with the experimental results, the absolute configuration can be assigned. (13)C NMR computation is an important method. This review will give introduction about uses of these methods in the configuration determination for compounds with different stereogenic centers.
关键词Chiral Compounds Optical Rotation Calculation (13)c Nmr Calculation Matrix Configuration Determination
收录类别SCI
语种英语
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文献类型期刊论文
条目标识符http://ir.kib.ac.cn/handle/151853/5040
专题植物化学与西部植物资源持续利用国家重点实验室
作者单位Chinese Acad Sci, Kunming Inst Bot, Organ Synth & Nat Prod Chem Lab, State Key Lab Phytochem & Plant Resources W China, Kunming 650204, Peoples R China
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Ren Jie,Zhu Hua-Jie. Application of Computational Chemistry in Identification for Chiral Compounds[J]. CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE,2009,30(10):1907-1918.
APA Ren Jie,&Zhu Hua-Jie.(2009).Application of Computational Chemistry in Identification for Chiral Compounds.CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE,30(10),1907-1918.
MLA Ren Jie,et al."Application of Computational Chemistry in Identification for Chiral Compounds".CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE 30.10(2009):1907-1918.
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