Hydration in Molecular Crystals-A Cambridge Structural Database Analysis

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• 作者：Amy L. Gillon ; Neil Feeder ; Roger J. Davey ; and Richard Storey
• 刊名：Crystal Growth & Design
• 出版年：2003
• 出版时间：September 2003
• 年：2003
• 卷：3
• 期：5
• 页码：663 - 673
• 全文大小：528K
• 年卷期：v.3,no.5(September 2003)
• ISSN：1528-7505

文摘

The Cambridge Structural Database has been used to investigate the detailed environment of watermolecules, hydrogen bonded to oxygen and nitrogen atoms, within molecular crystal hydrates. Eight coordinationstates of water have been investigated for 3315 structures, and hydrogen bond length and angle data were obtainedand analyzed. The two most common environments are those in which water forms either three or four hydrogenbonds to neighboring molecules.