Information card for entry 8103301

Structure parameters

• Formula: C22 H28 N2 O6
• Calculated formula: C22 H28 N2 O6
• Title of publication: Crystal structure of bis(2-hydroxy-3-ethoxybenzaldehyde) O,O'-(butane-1,4-diyl)dioxime, C22H28N2O6
• Authors of publication: Wen-Kui Dong; Sen-Hua Liu; Shou-Ting Zhang; Li Wang; Yu-Jie Zhang; Xiong-Hou Gao
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2012
• Journal volume: 227
• Journal issue: 1
• Pages of publication: 15
• a: 4.6719 ± 0.0005 Å
• b: 18.0917 ± 0.0017 Å
• c: 12.4084 ± 0.0011 Å
• α: 90°
• β: 93.914 ± 0.001°
• γ: 90°
• Cell volume: 1046.34 ± 0.18 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0896
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.0776
• Weighted residual factors for all reflections included in the refinement: 0.0864
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No