The asymmetric unit of the title hydrated salt, C13H11N2 (+)·C7H6NO2 (-)·2H2O, consists of two independent 9-amino-acridinium cations, two 4-amino-benzoate anions and four water mol-ecules. Both 9-amino-acridinium cations are essentially planar, with maximum deviations of 0.034â (1) and 0.025â (2)â à , and are protonated at the pyridine N atoms. The 4-amino-benzoate anions are approximately planar, with dihedral angles of 9.16â (19) and 5.4â (2)° between the benzene ring and the carboxyl-ate group. In the crystal, the two independent anions are connected by N-Hâ¯O hydrogen bonds, forming a layer parallel to (100). The layers are connected through the cations by N-Hâ¯N and N-Hâ¯O hydrogen bonds. The water mol-ecules, which form O-Hâ¯O hydrogen-bonded chains along the b-axis direction, connect the anions and the cations by O-Hâ¯O, N-Hâ¯O and C-Hâ¯O hydrogen bonds. The crystal structure also features Ï-Ï inter-actions [centroid-centroid distances = 3.6343â (9)-3.8366â (10)â à ] and a C-Hâ¯Ï inter-action.
9-Amino-acridin-10-ium 4-amino-benzo-ate dihydrate.
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作者:Dhanabalan Nallathambi, Thanigaimani Kaliyaperumal, Arshad Suhana, Razak Ibrahim Abdul, Santhanaraj K Joseph
| 期刊: | Acta Crystallographica Section E-Structure Reports Online | 影响因子: | 0.600 |
| 时间: | 2014 | 起止号: | 2014 May 17; 70(Pt 6):o657-8 |
| doi: | 10.1107/S160053681401023X | ||
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