Information card for entry 2021252

Structure parameters

• Chemical name: (enH)~2~[{Cu(2,2'-bipy)(en)}~2~(μ~4~-H~3~BiW~18~O~60~)], 5.5H~2~O
• Formula: C28 H64 Bi Cu2 N12 O65.5 W18
• Calculated formula: C28 H53.9996 Bi Cu2 N12 O62 W18
• Title of publication: A novel two-dimensional layered Cu^2+^ complex based on Dawson-like [H~3~BiW~18~O~60~]^6{-^}: synthesis, structure and magnetic properties
• Authors of publication: He, Shuai; Xin, Ying; Li, Jiansheng; Zhu, Zaiming; Zhao, Peng; You, Wansheng
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 11
• a: 16.0955 ± 0.001 Å
• b: 12.9013 ± 0.0008 Å
• c: 19.2456 ± 0.0012 Å
• α: 90°
• β: 101.664 ± 0.001°
• γ: 90°
• Cell volume: 3913.9 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• 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: 0.0562
• Residual factor for significantly intense reflections: 0.0355
• Weighted residual factors for significantly intense reflections: 0.0682
• Weighted residual factors for all reflections included in the refinement: 0.0741
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No