Information card for entry 7219835

Structure parameters

• Formula: C56 H48 N16 O12 Zn2
• Calculated formula: C56 H40 N16 O8 Zn2
• Title of publication: Coordination assemblies of seven metal-organic frameworks based on a bent connector: structural diversity and properties
• Authors of publication: Song, Bai-Qiao; Qin, Chao; Zhang, Yu-Teng; Wu, Xue-Song; Liu, Hong-Sheng; Shao, Kui-Zhan; Su, Zhong-Min
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 16
• Pages of publication: 3129
• a: 11.705 ± 0.005 Å
• b: 13.456 ± 0.005 Å
• c: 18.636 ± 0.005 Å
• α: 95.216 ± 0.005°
• β: 90.707 ± 0.005°
• γ: 109.834 ± 0.005°
• Cell volume: 2746.7 ± 1.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1063
• Residual factor for significantly intense reflections: 0.0552
• Weighted residual factors for significantly intense reflections: 0.1056
• Weighted residual factors for all reflections included in the refinement: 0.1171
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No