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Figure 3
(a) Overlap of experimentally observed conformations of (3), (3a) and (4); (b) six best conformers generated for the S-form of the mol­ecule in (4) (light purple) using CSD-discovery (Mercury; Macrae et al., 2020BB14) – the dark purple one is the experimentally observed conformation.

Journal logoCRYSTALLOGRAPHIC
COMMUNICATIONS
ISSN: 2056-9890
Volume 79| Part 5| May 2023| Pages 488-493
https://doi.org/10.1107/S2056989023003353
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