Information card for entry 4507726

Structure parameters

• Formula: C46 H32 N4 O7 Zn
• Calculated formula: C46 H32 N4 O7 Zn
• Title of publication: Tuning Structural Topologies of a Series of Metal‒Organic Frameworks: Different Bent Dicarboxylates
• Authors of publication: Qin, Ling; Hu, Jinsong; Zhang, Mingdao; Yang, Qingxiang; Li, Yizhi; Zheng, Hegen
• Journal of publication: Crystal Growth & Design
• Year of publication: 2013
• Journal volume: 13
• Journal issue: 5
• Pages of publication: 2111
• a: 13.5717 ± 0.0012 Å
• b: 13.5717 ± 0.0012 Å
• c: 37.332 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 5955 ± 1.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 170
• Hermann-Mauguin space group symbol: P 65
• Hall space group symbol: P 65
• Residual factor for all reflections: 0.0786
• Residual factor for significantly intense reflections: 0.0455
• Weighted residual factors for significantly intense reflections: 0.063
• Weighted residual factors for all reflections included in the refinement: 0.0659
• Goodness-of-fit parameter for all reflections included in the refinement: 1.133
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No