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  4. Cimetidine, C10H16N6S, form C: crystal structure and modelling of polytypes using the superspace approach
 
research article

Cimetidine, C10H16N6S, form C: crystal structure and modelling of polytypes using the superspace approach

Arakcheeva, Alla  
•
Pattison, Philip  
•
Bauer-Brandl, Annette
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2013
Journal of Applied Crystallography

An efficient method for modelling a polytypic family is presented with the example of cimetidine in the form C polymorph. The method exploits the (3 + 1)-dimensional superspace model, which is a powerful tool for the description, prediction and understanding of polytype modifications in small-molecule crystallography, as illustrated with this pharmaceutical example.

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