Information card for entry 7249387

Structure parameters

• Formula: C11 H11 N Ni O6
• Calculated formula: C11 H11 N Ni 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: 17.078 ± 0.002 Å
• b: 9.7734 ± 0.0014 Å
• c: 7.2286 ± 0.0011 Å
• α: 90°
• β: 102.954 ± 0.005°
• γ: 90°
• Cell volume: 1175.8 ± 0.3 ų
• Cell temperature: 273.15 K
• Ambient diffraction temperature: 273.15 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0565
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1397
• Weighted residual factors for all reflections included in the refinement: 0.1404
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No