Are oxygen and sulfur atoms structurally equivalent in organic crystals?

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Are oxygen and sulfur atoms structurally equivalent in organic crystals?

Corpinot, MK; Guo, R; Tocher, DA; Buanz, ABM; Gaisford, S; Price, SL; Bučar, DK; (2017) Are oxygen and sulfur atoms structurally equivalent in organic crystals? Crystal Growth and Design , 17 (2) pp. 827-833. 10.1021/acs.cgd.6b01669. Green open access

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Abstract

New guidelines for the design of structurally equivalent molecular crystals were derived from structural analyses of new cocrystals and polymorphs of saccharin and thiosaccharin, aided by a computational study. The study shows that isostructural crystals may be obtained through an exchange of >C?O with >C?S in the molecular components of the solids, but only if the exchanged atom is not involved in hydrogen bonding.

Type:	Article
Title:	Are oxygen and sulfur atoms structurally equivalent in organic crystals?
Open access status:	An open access version is available from UCL Discovery
DOI:	10.1021/acs.cgd.6b01669
Publisher version:	http://doi.org/10.1021/acs.cgd.6b01669
Language:	English
Additional information:	© 2016 American Chemical Society. ACS AuthorChoice - This is an open access article published under a Creative Commons Attribution (CC-BY) License, which permits unrestricted use, distribution and reproduction in any medium, provided the author and source are cited.
UCL classification:	UCL UCL > Provost and Vice Provost Offices > School of Life and Medical Sciences UCL > Provost and Vice Provost Offices > School of Life and Medical Sciences > Faculty of Life Sciences UCL > Provost and Vice Provost Offices > School of Life and Medical Sciences > Faculty of Life Sciences > UCL School of Pharmacy UCL > Provost and Vice Provost Offices > School of Life and Medical Sciences > Faculty of Life Sciences > UCL School of Pharmacy > Pharmaceutics UCL > Provost and Vice Provost Offices > UCL BEAMS UCL > Provost and Vice Provost Offices > UCL BEAMS > Faculty of Maths and Physical Sciences UCL > Provost and Vice Provost Offices > UCL BEAMS > Faculty of Maths and Physical Sciences > Dept of Chemistry
URI:	https://discovery.ucl.ac.uk/id/eprint/1542264

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