Information card for entry 4505098

Structure parameters

• Formula: C14 H16 Cl2 Cu N8 O8
• Calculated formula: C14 H16 Cl2 Cu N8 O8
• Title of publication: Multidimensional Metal−Organic Frameworks Constructed from Flexible Bis(imidazole) Ligands
• Authors of publication: Cui, Guang-Hua; Li, Jian-Rong; Tian, Jin-Lei; Bu, Xian-He; Batten, Stuart R.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2005
• Journal volume: 5
• Journal issue: 5
• Pages of publication: 1775
• a: 9.131 ± 0.003 Å
• b: 9.253 ± 0.003 Å
• c: 12.435 ± 0.004 Å
• α: 90°
• β: 92.58 ± 0.005°
• γ: 90°
• Cell volume: 1049.6 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0655
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.1139
• Weighted residual factors for all reflections included in the refinement: 0.1244
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No