Information card for entry 2234006

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>'-(2-Hydroxy-3,5-diiodobenzylidene)-3-methylbenzohydrazide
• Formula: C15 H12 I2 N2 O2
• Calculated formula: C15 H12 I2 N2 O2
• SMILES: Ic1c(O)c(cc(I)c1)/C=N/NC(=O)c1cccc(c1)C
• Title of publication: (<i>E</i>)-<i>N</i>'-(2-Hydroxy-3,5-diiodobenzylidene)-3-methylbenzohydrazide
• Authors of publication: Tang, Chun-Bao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 3
• Pages of publication: o603
• a: 14.778 ± 0.003 Å
• b: 11.764 ± 0.003 Å
• c: 9.848 ± 0.0019 Å
• α: 90°
• β: 102.191 ± 0.002°
• γ: 90°
• Cell volume: 1673.5 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.1158
• Residual factor for significantly intense reflections: 0.0688
• Weighted residual factors for significantly intense reflections: 0.1523
• Weighted residual factors for all reflections included in the refinement: 0.1746
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes