Information card for entry 7207399

Structure parameters

• Formula: C39 H36 N8 O9 Zn2
• Calculated formula: C39 H36 N8 O9 Zn2
• Title of publication: Three unprecedented open frameworks based on a pyridyl-carboxylate: synthesis, structures and properties
• Authors of publication: Su, Shengqun; Chen, Wan; Song, Xuezhi; Zhu, Min; Qin, Chao; Song, Shuyan; Guo, Zhiyong; Wang, Song; Hao, Zhaoming; Li, Guanghua; Zhang, Hongjie
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 5
• Pages of publication: 1681
• a: 6.1802 ± 0.0004 Å
• b: 29.4218 ± 0.0018 Å
• c: 23.3127 ± 0.0014 Å
• α: 90°
• β: 95.663 ± 0.001°
• γ: 90°
• Cell volume: 4218.3 ± 0.5 ų
• Cell temperature: 185 ± 2 K
• Ambient diffraction temperature: 185 ± 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: 0.1023
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for significantly intense reflections: 0.1848
• Weighted residual factors for all reflections included in the refinement: 0.21
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No