Information card for entry 7205425

Structure parameters

• Formula: C17 H11 Cd N4 O4
• Calculated formula: C17 H11 Cd N4 O4
• 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: 6.059 ± 0.004 Å
• b: 17.373 ± 0.012 Å
• c: 14.478 ± 0.01 Å
• α: 90°
• β: 90 ± 0.001°
• γ: 90°
• Cell volume: 1524 ± 1.8 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0374
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0767
• Weighted residual factors for all reflections included in the refinement: 0.0787
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No