Information card for entry 8105648

Structure parameters

• Formula: C22 H22 N2 O5 S
• Calculated formula: C22 H22 N2 O5 S
• Title of publication: Crystal structure of N′-((1E,2E)-4-(7-methoxy-2-oxo-2H-chromen-8-yl)-2-methylbut-2-en-1-ylidene)-4-methylbenzenesulfonohydrazide, C22H22O5N2S
• Authors of publication: Yu, Xiang; Qin, Yan; Yan, Jing; Chen, Ya-Fang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 2
• Pages of publication: 367 - 368
• a: 8.108 ± 0.0002 Å
• b: 14.4763 ± 0.0004 Å
• c: 18.2819 ± 0.0005 Å
• α: 90°
• β: 95.27 ± 0.003°
• γ: 90°
• Cell volume: 2136.75 ± 0.1 ų
• Cell temperature: 291 K
• Ambient diffraction temperature: 291 K
• Number of distinct elements: 5
• 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: 0.064
• Residual factor for significantly intense reflections: 0.0488
• Weighted residual factors for significantly intense reflections: 0.115
• Weighted residual factors for all reflections included in the refinement: 0.122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No