Information card for entry 2231408

Structure parameters

• Chemical name: <i>N</i>'-[(<i>E</i>)-2-Hydroxy-3,5-diiodobenzylidene]pyridine-3-carbohydrazide
• Formula: C13 H9 I2 N3 O2
• Calculated formula: C13 H9 I2 N3 O2
• SMILES: c1c(cc(c(c1/C=N/NC(=O)c1cccnc1)O)I)I
• Title of publication: <i>N</i>'-[(<i>E</i>)-2-Hydroxy-3,5-diiodobenzylidene]pyridine-3-carbohydrazide
• Authors of publication: Thirugnanasundar, A.; Suresh, J.; Ramu, A.; RajaGopal, G.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 9
• Pages of publication: o2303
• a: 17.48 ± 0.0005 Å
• b: 8.571 ± 0.0004 Å
• c: 9.865 ± 0.0003 Å
• α: 90°
• β: 90.451 ± 0.004°
• γ: 90°
• Cell volume: 1477.94 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0503
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0942
• Weighted residual factors for all reflections included in the refinement: 0.1056
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes