Information card for entry 1561823

Structure parameters

• Formula: C20 H18 Br2 Cd Cl N4 O2
• Calculated formula: C20 H18 Br2 Cd Cl N4 O2
• Title of publication: Transition metal coordination polymers based on tetrabromoterephthalic and bis(imidazole) ligands: Syntheses, structures, topological analysis and photoluminescence properties
• Authors of publication: Zhang, Xiaowei; Xing, Peiqi; Geng, Xiujuan; Sun, Daofeng; Xiao, Zhenyu; Wang, Lei
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2015
• Journal volume: 229
• Pages of publication: 49 - 61
• a: 14.8105 ± 0.0002 Å
• b: 13.94092 ± 0.00014 Å
• c: 11.53789 ± 0.00019 Å
• α: 90°
• β: 112.742 ± 0.0018°
• γ: 90°
• Cell volume: 2197.04 ± 0.06 ų
• Cell temperature: 294.54 ± 0.1 K
• Ambient diffraction temperature: 294.54 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0295
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0614
• Weighted residual factors for all reflections included in the refinement: 0.0642
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No