The organic molecule in the title dihydrate, C12H9FN4O·2H2O, exists in the E conformation with respect to the azo-methane C=N double bond. The mol-ecule is approximately planar, with a maximum deviation of 0.117â (1)â à for the carbonyl O atom from the mean plane of the mol-ecule. Both pyridine rings are essentially coplanar with the central C(=O)N2C unit [dihedral angles = 1.99â (7) and 5.71â (8)°], exhibiting a significant difference in dihedral angles from its benzohydrazide analogue. The crystal packing features N-Hâ¯O, O-Hâ¯N and O-Hâ¯O hydrogen-bond inter-actions, which lead to the formation of a chain along the c-axis direction through one of the water mol-ecules present, and these chains are stacked one over the other by means of Ï-Ï inter-actions [with centroid-centroid distances of 3.7099â (10) and 3.6322â (10)â à ] between the aromatic rings in neighbouring anti-parallel mol-ecules, building a three-dimensional supra-molecular network.
N'-[(E)-(3-Fluoro-pyridin-2-yl)methyl-idene]pyridine-3-carbohydrazide dihydrate.
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作者:Nair Yamuna, Sithambaresan M, Nair S Muraleedharan, Kurup M R Prathapachandra
| 期刊: | Acta Crystallographica Section E-Structure Reports Online | 影响因子: | 0.600 |
| 时间: | 2014 | 起止号: | 2014 Mar 26; 70(Pt 4):o483-4 |
| doi: | 10.1107/S1600536814006072 | ||
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