Information card for entry 7106011

Structure parameters

• Formula: C25 H32 Br Cd N2 O11
• Calculated formula: C25 H32 Br Cd N2 O11
• Title of publication: 2D flexible metal-organic frameworks with [Cd2(u2-X)2](X = Cl or Br) units exhibiting selective fluorescence sensing for small molecules
• Authors of publication: Xu-Hui Jin Jian-Ke Sun Li-Xuan Cai Jie Zhang
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 2667
• a: 17.595 ± 0.004 Å
• b: 18.176 ± 0.005 Å
• c: 18.778 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6005 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0824
• Residual factor for significantly intense reflections: 0.0796
• Weighted residual factors for significantly intense reflections: 0.1595
• Weighted residual factors for all reflections included in the refinement: 0.1612
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No