Author:
Yamuna Thammarse S.,Kaur Manpreet,Anderson Brian J.,Jasinski Jerry P.,Yathirajan H.S.
Abstract
In the title salt, C23H26F3N2OS+·C4H5O6−[systematic name: 1-(2-hydroxyethyl)-4-[3-(2-(trifluoromethyl)thioxanthen-9-ylidene)propyl]piperazin-1-ium 3-carboxy-2,3-dihydroxypropionate], the monoprotonated piperazine ring in the cation adopts a chair conformation, while the thiopyran ring of the thioxanthene group has a boat conformation. The dihedral angle between the mean planes of the two outer aromatic rings of the thioxanthene groups is 31.6 (2)°. In the crystal, the cations and anions are linkedviaO—H...O, N—H...O, O—H...N and C—H...O hydrogen bonds, forming chains propagating along [100]. In addition,R22(7),R22(11),R22(10) andR22(12) graph-set ring motifs involving the anions, andR22(9) graph-set ring motifs involving both the cations and anions are observed. The three F atoms of the trifluoromethyl group are disordered over two sets of sites and the individual atoms were refined with occupancy ratios of 0.54 (6):0.46 (6), 0.72 (2):0.28 (2) and 0.67 (3):0.33 (3).
Publisher
International Union of Crystallography (IUCr)
Subject
Condensed Matter Physics,General Materials Science,General Chemistry
Cited by
4 articles.
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