Publication: Crystal Structure and Hirshfeld Surface Analysis of 2-amino-3-hydroxypyridin-1-ium 6-methyl-2,2,4-trioxo-2H,4H-1,2,3-oxathiazin-3-ide
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Abstract
The asymmetric unit of the title compound, C5H7N2O+·C4H4NO4S-, contains one cation and one anion. The 6-methyl-2,2,4-trioxo-2H,4H-1,2,3-oxathiazin-3-ide anion adopts an envelope conformation with the S atom as the flap. In the crystal, the anions and cations are held together by N - H⋯O, N - H⋯N, O - H⋯O and C - H⋯O hydrogen bonds, thus forming a three-dimensional structure. The Hirshfeld surface analysis and fingerprint plots reveal that the crystal packing is dominated by O⋯H/H⋯O (43.1%) and H⋯H (24.2%) contacts. © 2020 International Union of Crystallography.
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WoS Q
Scopus Q
Q3
Source
Acta Crystallographica Section E-Crystallographic Communications
Volume
76
Issue
Start Page
572
End Page
575
