Information card for entry 7056928

Structure parameters

• Formula: C22 H20 N2 O6 Zn0.81
• Calculated formula: C22 H20 N2 O6 Zn0.805
• Title of publication: Temperature-induced self-assembly of two kinds Zn(ii)-based coordination polymers with luminescence properties for application in sensing and adsorption
• Authors of publication: Liu, Yan; Liu, Wei; Xu, Cong; Dou, Wei; Ju, Zhenghua; Liu, Weisheng
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 5
• Pages of publication: 3885
• a: 12.9 ± 0.008 Å
• b: 5.117 ± 0.003 Å
• c: 36.695 ± 0.019 Å
• α: 90°
• β: 109.44 ± 0.018°
• γ: 90°
• Cell volume: 2284 ± 2 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 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: 0.2559
• Residual factor for significantly intense reflections: 0.2314
• Weighted residual factors for significantly intense reflections: 0.5155
• Weighted residual factors for all reflections included in the refinement: 0.5282
• Goodness-of-fit parameter for all reflections included in the refinement: 1.15
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No