N‐(6‐Methylpyridin‐2‐yl)mesitylenesulfonamide and acetic acid – a salt, a cocrystal or both?
In the solid obtained from N‐(6‐methylpyridin‐2‐yl)mesitylenesulfonamide and acetic acid, the constituents interact via two N—H...O hydrogen bonds. The H atom situated in one of these short contacts is disordered over two positions: one of these positions is formally associated with an adduct of the...
Gespeichert in:
Veröffentlicht in: | Acta crystallographica. Section C, Crystal structure communications Crystal structure communications, 2015-08, Vol.71 (8), p.653-657 |
---|---|
Hauptverfasser: | , , |
Format: | Artikel |
Sprache: | eng |
Schlagworte: | |
Online-Zugang: | Volltext |
Tags: |
Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
|
Zusammenfassung: | In the solid obtained from N‐(6‐methylpyridin‐2‐yl)mesitylenesulfonamide and acetic acid, the constituents interact via two N—H...O hydrogen bonds. The H atom situated in one of these short contacts is disordered over two positions: one of these positions is formally associated with an adduct of the neutral sulfonamide molecule and the neutral acetic acid molecule, and corresponds to a cocrystal, while the alternative site is associated with salt formation between a protonated sulfonamide molecule and deprotonated acetic acid molecule. Site‐occupancy refinements and electron densities from difference Fourier maps suggest a trend with temperature, albeit of limited significance; the cocrystal is more relevant at 100 K, whereas the intensity data collected at room temperature match the description as cocrystal and salt equally well. |
---|---|
ISSN: | 2053-2296 0108-2701 2053-2296 1600-5759 |
DOI: | 10.1107/S2053229615012826 |