Information card for entry 4340166

Structure parameters

• Formula: C26 H16 Cu N2 O9
• Calculated formula: C26 H16 Cu N2 O9
• Title of publication: One dense and two open chiral metal-organic frameworks: crystal structures and physical properties.
• Authors of publication: Zang, Shuangquan; Su, Yang; Li, Yizhi; Zhu, Huizhen; Meng, Qingjin
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 7
• Pages of publication: 2972 - 2978
• a: 10.963 ± 0.002 Å
• b: 10.963 ± 0.002 Å
• c: 16.034 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1668.9 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 152
• Hermann-Mauguin space group symbol: P 31 2 1
• Hall space group symbol: P 31 2"
• Residual factor for all reflections: 0.0778
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.1523
• Weighted residual factors for all reflections included in the refinement: 0.1567
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No