Acta Cryst. (2014). E70, o95-o96 [ doi:10.1107/S1600536813034077 ]
Abstract: The asymmetric unit of the title compound, 2C18H16N4O2·H2O, consists of two organic molecules and one solvent molecule. The symmetry-independent organic molecules have slightly different conformations: the 1,2,4-triazole ring forms dihedral angles of 84.61 (4), 89.68 (5) and 22.38 (6)°, respectively, with the 2-propenecarbocylic, p-tolyl and 4-pyridyl groups in one independent molecule, and 71.35 (4), 82.13 (5) and 24.82 (6)°, respectively, in the second. In the crystal, molecules ralated by the 21 screw axes are assembled via O-HN and O-HO hydrogen bonds into infinite chains and these are linked by further O-HN hydrogen bonds into undulating sheets parallel to the bc plane. Adjacent sheets are connected by weak C-HO interactions, forming a three-dimensional structure.
CCDC reference: 977733
Hyper-Text Markup Language (HTML) file (113.8 kbytes)
Chemical Markup Language (CML) file (6.7 kbytes)
To open or display or play some files, you may need to set your browser up to use the appropriate software. See the full list of file types for an explanation of the different file types and their related mime types and, where available links to sites from where the appropriate software may be obtained.
The download button will force most browsers to prompt for a file name to store the data on your hard disk.
Where possible, images are represented by thumbnails.
Copyright © International Union of Crystallography