Information card for entry 4330318

Structure parameters

• Formula: C46 H45 Cd2 N6 O10
• Calculated formula: C46 H45 Cd2 N6 O10
• Title of publication: Tuning Structural Topologies of Three Photoluminescent Metal-Organic Frameworks via Isomeric Biphenyldicarboxylates
• Authors of publication: Feng Guo; Fei Wang; Hui Yang; Xiuling Zhang; Jian Zhang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 9677 - 9682
• a: 8.604 ± 0.0011 Å
• b: 15.769 ± 0.0012 Å
• c: 17.344 ± 0.0012 Å
• α: 87.03 ± 0.0008°
• β: 83.939 ± 0.0011°
• γ: 80.751 ± 0.0012°
• Cell volume: 2308.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0588
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1248
• Weighted residual factors for all reflections included in the refinement: 0.1328
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No