Information card for entry 7219461

Structure parameters

• Formula: C27 H22 Br4 Cd N4 O5
• Calculated formula: C27 H22 Br4 Cd N4 O5
• Title of publication: A series of d10metal coordination polymers based on a flexible bis(2-methylbenzimidazole) ligand and different carboxylates: synthesis, structures, photoluminescence and catalytic properties
• Authors of publication: Hao, Jin-ming; Yu, Bao-yi; Van Hecke, Kristof; Cui, Guang-hua
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 11
• Pages of publication: 2279
• a: 9.5556 ± 0.0004 Å
• b: 12.1747 ± 0.0002 Å
• c: 12.9664 ± 0.0003 Å
• α: 84.089 ± 0.002°
• β: 89.206 ± 0.003°
• γ: 88.552 ± 0.002°
• Cell volume: 1499.87 ± 0.08 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.062
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for significantly intense reflections: 0.1431
• Weighted residual factors for all reflections included in the refinement: 0.1476
• Goodness-of-fit parameter for all reflections included in the refinement: 1.127
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No