Information card for entry 7205424

Structure parameters

• Formula: C34 H32 Cd2 N8 O13
• Calculated formula: C34 H22 Cd2 N8 O13
• 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: 9.22 ± 0.0018 Å
• b: 18.831 ± 0.004 Å
• c: 10.75 ± 0.002 Å
• α: 90°
• β: 104.087 ± 0.002°
• γ: 90°
• Cell volume: 1810.3 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0362
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for significantly intense reflections: 0.0773
• Weighted residual factors for all reflections included in the refinement: 0.0794
• Goodness-of-fit parameter for all reflections included in the refinement: 1.181
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No