Exploring the crystal landscape of mandelamide and chiral resolution via cocrystallization

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dc.contributor.authorHuang, Shanen
dc.contributor.authorFitzgerald, Deirbhileen
dc.contributor.authorKoledoye, Samuel A.en
dc.contributor.authorCollins, Stuart G.en
dc.contributor.authorMaguire, Anita R.en
dc.contributor.authorLawrence, Simon E.en
dc.contributor.funderScience Foundation Irelanden
dc.contributor.funderIrish Research Councilen
dc.date.accessioned2025-01-06T13:28:31Z
dc.date.available2025-01-06T13:28:31Z
dc.date.issued2025en
dc.description.abstractThe crystal structures of (±)-mandelamide, S-mandelamide, and enantioenriched mandelamide (94 S : 6 R) were determined. Diastereomeric cocrystal pairs of S-mandelamide with both enantiomers of mandelic acid and proline were synthesized. The diastereomeric cocrystal pairs of S-mandelamide with S/R-mandelic acid form 1:1 cocrystals in each case, while the diastereomeric cocrystal pairs of S-mandelamide with proline have different stoichiometries. Preliminary investigation of this diastereomeric cocrystal system for chiral resolution shows promise.en
dc.description.sponsorshipIrish Research Council (Project ID GOIPG/2021/158)en
dc.description.statusPeer revieweden
dc.description.versionPublished Versionen
dc.format.mimetypeapplication/pdfen
dc.identifier.citationHuang, S., Fitzgerald, D., Koledoye, S.A., Collins, S.G., Maguire, A.R. and Lawrence, S.E. (2025) ‘Exploring the crystal landscape of mandelamide and chiral resolution via cocrystallization’, Crystal Growth & Design, 25(1), pp. 1–12. https://doi.org/10.1021/acs.cgd.3c01513en
dc.identifier.doihttps://doi.org/10.1021/acs.cgd.3c01513en
dc.identifier.endpage12en
dc.identifier.issued1en
dc.identifier.journaltitleCrystal Growth & Designen
dc.identifier.startpage1en
dc.identifier.urihttps://hdl.handle.net/10468/16778
dc.identifier.volume25en
dc.language.isoenen
dc.publisherAmerican Chemical Societyen
dc.relation.projectinfo:eu-repo/grantAgreement/SFI/SFI Research Centres/12/RC/2275_P2/IE/Synthesis and Solid State Pharmaceutical Centre (SSPC)/en
dc.rights© 2024, The Authors. Published byAmerican Chemical Society. This document is the Accepted Manuscript version of a Published Work that appeared in final form in Crystal Growth & Design, copyright © American Chemical Society after peer review and technical editing by the publisher. To access the final edited and published work see https://pubs.acs.org/doi/epdf/10.1021/acs.cgd.3c01513?ref=articleen
dc.rights.urihttps://creativecommons.org/licenses/by/4.0/en
dc.subjectCrystal structureen
dc.subjectCrystallizationen
dc.subjectDiffractionen
dc.subjectMoleculesen
dc.subjectNoncovalent interactionsen
dc.titleExploring the crystal landscape of mandelamide and chiral resolution via cocrystallizationen
dc.typeArticle (peer-reviewed)en
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