Information card for entry 2222145

Structure parameters

• Chemical name: <i>N</i>'-(2-Hydroxy-3,5-diiodobenzylidene)-2-methoxybenzohydrazide
• Formula: C15 H12 I2 N2 O3
• Calculated formula: C15 H12 I2 N2 O3
• SMILES: COc1ccccc1C(=O)N/N=C/c1cc(I)cc(c1O)I
• Title of publication: <i>N</i>'-(2-Hydroxy-3,5-diiodobenzylidene)-2-methoxybenzohydrazide
• Authors of publication: Peng, San-Jun; Zhang, Fen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: o1410
• a: 16.073 ± 0.002 Å
• b: 15.628 ± 0.002 Å
• c: 13.284 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3336.8 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.078
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.089
• Weighted residual factors for all reflections included in the refinement: 0.1008
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes