Information card for entry 7157489

Structure parameters

• Formula: C210 H270 B6 N6 O24
• Calculated formula: C210 H269.5 B6 N6 O24
• Title of publication: Preparation of cage-shaped hexakis(spiroborate)s.
• Authors of publication: Danjo, Hiroshi; Masuda, Yuhki; Kidena, Yuki; Kawahata, Masatoshi; Ohara, Kazuaki; Yamaguchi, Kentaro
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2020
• Journal volume: 18
• Journal issue: 19
• Pages of publication: 3717 - 3723
• a: 42.922 ± 0.009 Å
• b: 30.652 ± 0.006 Å
• c: 19.133 ± 0.004 Å
• α: 90°
• β: 94.97 ± 0.03°
• γ: 90°
• Cell volume: 25078 ± 9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.1391
• Residual factor for significantly intense reflections: 0.1064
• Weighted residual factors for significantly intense reflections: 0.3231
• Weighted residual factors for all reflections included in the refinement: 0.3545
• Goodness-of-fit parameter for all reflections included in the refinement: 1.324
• Diffraction radiation wavelength: 0.75 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No