Statistics-Based Design of Multicomponent Molecular Crystals with the Three-Center Hydrogen Bond
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https://figshare.com/articles/dataset/Statistics_Based_Design_of_Multicomponent_Molecular_Crystals_with_the_Three_Center_Hydrogen_Bond/2867746
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资源简介:
A statistical survey was carried out to determine the probability for combinations of specific CO and NH groups to form a three-center hydrogen bond between one CO and two NH groups. The results show significantly higher probabilities for charged CO− groups. These results were utilized to prepare six multicomponent crystals that exploit the three-center hydrogen bond mainly through the R42(8) motif.
创建时间:
2016-02-26



