Information card for entry 1554950

Structure parameters

• Formula: C152.5 H199 B4 N7 O23
• Calculated formula: C152.028 H198.732 B4 N6.676 O22.676
• Title of publication: Nestable Tetrakis(spiroborate) Nanocycles.
• Authors of publication: Danjo, Hiroshi; Hashimoto, Yuhki; Kidena, Yuki; Nogamine, Ayumi; Katagiri, Kosuke; Kawahata, Masatoshi; Miyazawa, Toshifumi; Yamaguchi, Kentaro
• Journal of publication: Organic letters
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 9
• Pages of publication: 2154 - 2157
• a: 11.705 ± 0.002 Å
• b: 28.512 ± 0.006 Å
• c: 22.406 ± 0.005 Å
• α: 90°
• β: 98.94 ± 0.03°
• γ: 90°
• Cell volume: 7387 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1905
• Residual factor for significantly intense reflections: 0.1828
• Weighted residual factors for significantly intense reflections: 0.4757
• Weighted residual factors for all reflections included in the refinement: 0.5029
• Goodness-of-fit parameter for all reflections included in the refinement: 2.579
• Diffraction radiation wavelength: 0.8 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No