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[求助]
求一个晶体结构的命名
投Acta Crystallographica Section E,给化合物命名,编辑总说不对,我用chemDraw命名的,他这样回复的”Chemical and crystallographic numbering should be in agreement wherever possible.
It means the following: if you write "5-hydroxy-8-metoxy..." then the atoms carrying hydroxy and metoxy groups should be labelled as C5 and C8 respectively.
If you write "3aS" then the corresponding atom in the CIF should be labelled as C3A.
This helps the reader to understand the structure. “
下面附上晶体结构图,和化学结构。
求助一下几点点:
1. 是不是这两个结构是刚好镜面对称的,它不是同一个物质?
2. 如果不是同一个物质,我是否应该按照单晶解析出来的结构画结构式?
3. 我用chemDraw命名是”(3aS,4S,5S,6aS,7R,8S,10R,10aR)-5-hydroxy-8-methoxy-4,7-dimethyldecahydrofuro[3,2-i]isochromen-10-yl acetate“,按照编辑说的我该怎么命名(按照晶体解析图来命名)?
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晶体解析图
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