Published in
Royal Society of Chemistry, CrystEngComm, 9(26), p. 1219-1233, 2024
DOI: 10.1039/d3ce01062g
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An unusual ionic cocrystal of ponatinib hydrochloride: characterization by single-crystal X-ray diffraction and ultra-high field NMR spectroscopy
Journal article published in 2024 by
Alexander J. Stirk 
,
Sean T. Holmes ,
Fabio E. S. Souza,
Ivan Hung ,
Zhehong Gan ,
James F. Britten,
Allan W. Rey,
Robert W. Schurko
,
Sean T. Holmes ,
Fabio E. S. Souza,
Ivan Hung ,
Zhehong Gan ,
James F. Britten,
Allan W. Rey,
Robert W. Schurko
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Abstract
We characterize an ionic cocrystal of ponatinib HCl using X-ray diffraction and solid-state NMR. Multinuclear NMR, with ultra-high fields up to 35.2 T, lays the groundwork for characterization of complex crystals in the absence of diffraction data.