Information card for entry 7249388

Structure parameters

• Formula: C11 H11 Co N O6
• Calculated formula: C11 H11 Co N O6
• Title of publication: Construction, structures, and magnetic studies of two cobalt(II) and nickel(II) coordination polymers displaying bex topology
• Authors of publication: Shao, Dong; Wu, Si-Tong; Ruan, Zhijun; Tian, Zhengfang; Shi, Le; Yang, Jiong
• Journal of publication: CrystEngComm
• Year of publication: 2024
• a: 7.2564 ± 0.0008 Å
• b: 9.876 ± 0.0015 Å
• c: 16.8793 ± 0.0019 Å
• α: 90°
• β: 100.663 ± 0.005°
• γ: 90°
• Cell volume: 1188.8 ± 0.3 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 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: 0.0345
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.0684
• Weighted residual factors for all reflections included in the refinement: 0.0718
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No