Information card for entry 7241598

Structure parameters

• Formula: C33 H31 Cd N5 O5
• Calculated formula: C33 H31 Cd N5 O5
• Title of publication: AB11O16(OH)2 (A = K and Cs): interpenetrating 2D layers with large birefringence
• Authors of publication: Chen, Zhen; Guo, Jingyu; Han, Shujuan; Zeng, Hao; Yang, Zhihua; Pan, Shilie
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 1
• Pages of publication: 35 - 39
• a: 10.1575 ± 0.001 Å
• b: 30.064 ± 0.003 Å
• c: 13.2675 ± 0.0009 Å
• α: 90°
• β: 130.775 ± 0.005°
• γ: 90°
• Cell volume: 3068.2 ± 0.5 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.0636
• Residual factor for significantly intense reflections: 0.0533
• Weighted residual factors for significantly intense reflections: 0.1207
• Weighted residual factors for all reflections included in the refinement: 0.1268
• Goodness-of-fit parameter for all reflections included in the refinement: 1.129
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No