5-Amino-3-carboxy-1H-1,2,4-triazol-4-ium nitrate monohydrate

Author:

Berrah Fadila,Bouchene Rafika,Bouacida Sofiane,Roisnel Thierry

Abstract

The two-dimensional crystal packing of the title compound, C3H5N4O2+·NO2·H2O, results from the stacking of well separated layers (i.e.with nothing between the layers) parallel to the (-113) plane in which adjacent cations adopt a head-to-head arrangement such that two –COOH groups are linkedviatwo water molecules (the water O atom behaves simultaneously as donor and acceptor of hydrogen bonds) and two –NH2groups are linked through two nitrate anions. This arrangement leads to alternating hydrophilic and hydrophobic zones in which O—H...O and N—H...O hydrogen bonds, respectively, are observed.

Publisher

International Union of Crystallography (IUCr)

Subject

Condensed Matter Physics,General Materials Science,General Chemistry

Reference12 articles.

1. 2-Amino-3-carboxypyridinium nitrate

2. 2-Amino-3-carboxypyrazin-1-ium nitrate monohydrate

3. Brandenburg, K. & Berndt, M. (2001). DIAMOND. Crystal Impact GbR, Bonn, Germany.

4. Bruker (2006). APEX2 and SAINT. Bruker AXS Inc., Madison, Wisconsin, USA.

5. SIR2004: an improved tool for crystal structure determination and refinement

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