Please use this identifier to cite or link to this item: http://dx.doi.org/10.25673/118326
Title: Crystal structure of 1,2,3,4-tetrahydroisoquinolin-2-ium (2S,3S)-3-carboxy-2,3-dihydroxypropanoate monohydrate
Author(s): Seidela, Rüdiger W.
Kolev, TsonkoLook up in the Integrated Authority File of the German National Library
Issue Date: 2024
Type: Article
Language: English
Abstract: The crystal structure of 1,2,3,4-tetra­hydro­isoquinolin-2-ium (2S,3S)-3-carb­oxy-2,3-di­hydroxy­propano­ate monohydrate, C9H12N+·C4H5O6−·H2O, at 115 K shows ortho­rhom­bic symmetry (space group P212121). The hydrogen tartrate anions and solvent water mol­ecules form an intricate diperiodic O—H⋯O hydrogen-bond network parallel to (001). The tetra­hydro­isoquinolinium cations are tethered to the anionic hydrogen-bonded layers through N—H⋯O hydrogen bonds. The crystal packing in the third direction is achieved through van der Waals contacts between the hydro­carbon tails of the tetra­hydro­isoquinolinium cations, resulting in hydro­phobic and hydro­philic regions in the crystal structure.
URI: https://opendata.uni-halle.de//handle/1981185920/120285
http://dx.doi.org/10.25673/118326
Open Access: Open access publication
License: (CC BY 4.0) Creative Commons Attribution 4.0(CC BY 4.0) Creative Commons Attribution 4.0
Journal Title: Acta crystallographica. Section E, Crystallographic communications
Publisher: International Union of Crystallography
Publisher Place: Chester
Volume: 80
Issue: 7
Original Publication: 10.1107/s2056989024005711
Page Start: 763
Page End: 766
Appears in Collections:Open Access Publikationen der MLU

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