Information card for entry 7130211

Structure parameters

• Formula: C42 H44 Cd2 N4 O21
• Calculated formula: C42 H44 Cd2 N4 O21
• Title of publication: Photochromic and Electrochromic Properties of Viologen-Based Multifunctional Cd-MOF
• Authors of publication: Zang, Shuang-Quan; Li, Hai-Yang; Hua, Xue; Fu, Ting; Liu, Xiao-Fei
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 8.74302 ± 0.00007 Å
• b: 23.97044 ± 0.00018 Å
• c: 10.19537 ± 0.00008 Å
• α: 90°
• β: 90.06°
• γ: 90°
• Cell volume: 2136.68 ± 0.03 ų
• Cell temperature: 200 ± 0.1 K
• Ambient diffraction temperature: 200 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0355
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.102
• Weighted residual factors for all reflections included in the refinement: 0.102
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No