Information card for entry 7219121

Structure parameters

• Formula: C12 H12 Cd O6
• Calculated formula: C12 H12 Cd O6
• Title of publication: Chiral or achiral: four isomeric Cd(ii) coordination polymers based on phenylenediacrylate ligands
• Authors of publication: Sun, Qian; Cheng, Ai-Ling; Wang, Kun; Yi, Xiu-Chun; Gao, En-Qing
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 6
• Pages of publication: 1389
• a: 5.3146 ± 0.0008 Å
• b: 11.977 ± 0.0018 Å
• c: 19.719 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1255.2 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 20
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Residual factor for all reflections: 0.0212
• Residual factor for significantly intense reflections: 0.0181
• Weighted residual factors for significantly intense reflections: 0.0459
• Weighted residual factors for all reflections included in the refinement: 0.0472
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No