An unusual ionic cocrystal of ponatinib hydrochloride: characterization by single-crystal X-ray diffraction and ultra-high field NMR spectroscopy-Reference-Cited by-同舟云学术

An unusual ionic cocrystal of ponatinib hydrochloride: characterization by single-crystal X-ray diffraction and ultra-high field NMR spectroscopy

Published:2024 Issue:9 Volume:26 Page:1219-1233
ISSN:1466-8033
Container-title:CrystEngComm
language:en
Short-container-title:CrystEngComm

Author:

Stirk Alexander J.¹^ORCID,Holmes Sean T.²³^ORCID,Souza Fabio E. S.¹,Hung Ivan³^ORCID,Gan Zhehong³^ORCID,Britten James F.⁴,Rey Allan W.¹,Schurko Robert W.²³^ORCID

Affiliation:

1. Apotex Pharmachem Inc., Brantford, ON, N3T 6B8, Canada

2. Department of Chemistry & Biochemistry, Florida State University, Tallahassee, FL 32306, USA

3. National High Magnetic Field Laboratory, Tallahassee, FL 32310, USA

4. MAX Diffraction Facility, McMaster University, Hamilton, ON, L8S 4M1, Canada

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.

Funder

Basic Energy Sciences

Natural Sciences and Engineering Research Council of Canada

Ontario Innovation Trust

Ontario Research Foundation

University of Windsor

National Science Foundation

National Institutes of Health

Publisher

Royal Society of Chemistry (RSC)

Link

http://pubs.rsc.org/en/content/articlepdf/2024/CE/D3CE01062G