无定形固体                        
                
                                
                        
                            多态性(计算机科学)                        
                
                                
                        
                            固态核磁共振                        
                
                                
                        
                            核磁共振谱数据库                        
                
                                
                        
                            材料科学                        
                
                                
                        
                            魔角纺纱                        
                
                                
                        
                            化学位移                        
                
                                
                        
                            衍射                        
                
                                
                        
                            计算                        
                
                                
                        
                            化学计量学                        
                
                                
                        
                            核磁共振波谱                        
                
                                
                        
                            结晶学                        
                
                                
                        
                            化学                        
                
                                
                        
                            谱线                        
                
                                
                        
                            核磁共振                        
                
                                
                        
                            物理化学                        
                
                                
                        
                            计算机科学                        
                
                                
                        
                            物理                        
                
                                
                        
                            有机化学                        
                
                                
                        
                            算法                        
                
                                
                        
                            光学                        
                
                                
                        
                            基因型                        
                
                                
                        
                            基因                        
                
                                
                        
                            生物化学                        
                
                                
                        
                            天文                        
                
                        
                    
                    
        
    
            
            标识
            
                                    DOI:10.1211/jpp.59.2.0009
                                    
                                
                                 
         
        
                
            摘要
            
            Abstract Magic-angle spinning NMR is now making a significant contribution to our understanding of the structure of polymorphs and solvates of pharmaceutical significance. This personal review article discusses a range of applications, with particular emphasis on information about crystallography, for which NMR can address problems that cannot be readily solved by diffraction techniques (such as dynamic disorder and non-stoichiometric hydration). Unlike diffractograms, NMR spectra yield immediate chemical information. Moreover, heterogeneous samples can be investigated and amorphous content provides no significant barrier to studies. Furthermore, NMR can be an effective technique for quantitation (down to the level of ca. 1%). Additional strength is being derived from computation of chemical shifts in solids, using a code that takes account of the spatial repetition inherent in crystalline materials.
         
            
 
                 
                
                    
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