Ontology highlight
ABSTRACT:
SUBMITTER: Scarperi A
PROVIDER: S-EPMC8347463 | biostudies-literature | 2021 Jul
REPOSITORIES: biostudies-literature
Scarperi Andrea A Barcaro Giovanni G Pajzderska Aleksandra A Martini Francesca F Carignani Elisa E Geppi Marco M
Molecules (Basel, Switzerland) 20210729 15
The characterization of the three-dimensional structure of solids is of major importance, especially in the pharmaceutical field. In the present work, NMR crystallography methods are applied with the aim to refine the crystal structure of carbimazole, an active pharmaceutical ingredient used for the treatment of hyperthyroidism and Grave's disease. Starting from previously reported X-ray diffraction data, two refined structures were obtained by geometry optimization methods. Experimental <sup>1< ...[more]