Information card for entry 7122961

Structure parameters

• Formula: C5 H4 B Er2 N Nb3 O94 P2 W15
• Calculated formula: C5 H4 B Er2 N Nb3 O94 P2 W15
• Title of publication: Boronic acid derivatized lanthanide‒polyoxometalates with novel B‒OH‒Ln and B‒O‒Nb bridges
• Authors of publication: Li, Shujun; Zhao, Yue; Qi, Huihui; Zhou, Yanfang; Liu, Shuxia; Ma, Xiaoming; Zhang, Jie; Chen, Xuenian
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 23.095 ± 0.0006 Å
• b: 14.2098 ± 0.0004 Å
• c: 28.0704 ± 0.0009 Å
• α: 90°
• β: 104.388 ± 0.003°
• γ: 90°
• Cell volume: 8923.1 ± 0.5 ų
• Cell temperature: 291.29 ± 0.1 K
• Ambient diffraction temperature: 291.29 ± 0.1 K
• Number of distinct elements: 9
• 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: 0.0574
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.0876
• Weighted residual factors for all reflections included in the refinement: 0.0963
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No