Information card for entry 7205426

Structure parameters

• Formula: C42 H34 Cd3 N8 O16
• Calculated formula: C42 H26 Cd3 N8 O16
• Title of publication: Anion- and auxiliary ligand-directed synthesis of cadmium(ii) complexes with 3,5-di(1H-imidazol-1-yl)benzoate
• Authors of publication: Su, Zhi; Zhao, Yue; Chen, Min; Sun, Wei-Yin
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 5
• Pages of publication: 1539
• a: 8.254 ± 0.003 Å
• b: 9.984 ± 0.005 Å
• c: 13.965 ± 0.005 Å
• α: 78.013 ± 0.013°
• β: 87.68 ± 0.04°
• γ: 69.43 ± 0.02°
• Cell volume: 1053.3 ± 0.8 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: 0.0376
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for significantly intense reflections: 0.0893
• Weighted residual factors for all reflections included in the refinement: 0.0926
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No