Acta Crystallographica Section E

Structure Reports Online

Volume 69, Part 10 (October 2013)


organic compounds



lh5643 scheme

Acta Cryst. (2013). E69, o1510-o1511    [ doi:10.1107/S1600536813023532 ]

(E)-2-[4-(Diethylamino)styryl]-1-methylquinolinium 4-fluorobenzenesulfonate monohydrate

H.-K. Fun, N. Kaewmanee, K. Chanawanno, N. Boonnak and S. Chantrapromma

Abstract: In the title hydrated molecular salt, C22H25N2+·C6H4FO3S-·H2O, the cation displays whole molecule disorder over two sets of sites in a 0.780 (5):0.220 (5) ratio. The quinolinium ring system is essentially planar, with r.m.s. deviations of 0.0162 and 0.0381 Å for the major and minor disorder components, respectively. The dihedral angles between the mean plane of the quinolinium ring system and the benzene ring are 5.1 (3) and 7.7 (11)°, respectively, for the major and minor components in the cation. In the crystal, cations, anions and water molecules are linked into chains along [010] by O-H...O hydrogen bonds and are further connected into a three-dimensional network by weak C-H...O and C-H...F interactions. In addition, [pi]-[pi] interactions with centroid-centroid distances of 3.634 (3), 3.702 (5) and 3.838 (5) Å are observed.


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