Information card for entry 4505099

Structure parameters

• Formula: C21 H24 Cl2 K0 N12 O8 S0 Zn
• Calculated formula: C21 H24 Cl2 N12 O8 Zn
• 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: 12.348 ± 0.005 Å
• b: 12.115 ± 0.005 Å
• c: 18.837 ± 0.008 Å
• α: 90°
• β: 100.775 ± 0.006°
• γ: 90°
• Cell volume: 2768 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0847
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.1432
• Weighted residual factors for all reflections included in the refinement: 0.1581
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No