Information card for entry 1547504

Structure parameters

• Formula: C114.47 H115.78 B3 N12.82 O14.82
• Calculated formula: C114.016 H114.704 B3 N12.672 O14.672
• Title of publication: Proton-Induced Assembly‒Disassembly Modulation of Spiroborate Twin-Bowl Polymers Bearing Pyridyl Groups
• Authors of publication: Danjo, Hiroshi; Hamaguchi, Masahiro; Asai, Kohei; Nakatani, Mizuki; Kawanishi, Hiroko; Kawahata, Masatoshi; Yamaguchi, Kentaro
• Journal of publication: Macromolecules
• Year of publication: 2017
• Journal volume: 50
• Journal issue: 20
• Pages of publication: 8028
• a: 23.269 ± 0.005 Å
• b: 18.286 ± 0.004 Å
• c: 33.209 ± 0.007 Å
• α: 90°
• β: 92.92 ± 0.03°
• γ: 90°
• Cell volume: 14112 ± 5 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1877
• Residual factor for significantly intense reflections: 0.123
• Weighted residual factors for significantly intense reflections: 0.3404
• Weighted residual factors for all reflections included in the refinement: 0.3887
• Goodness-of-fit parameter for all reflections included in the refinement: 1.286
• Diffraction radiation wavelength: 0.8 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No