Information card for entry 7150569

Structure parameters

• Formula: C45 H91.249 O43.6245
• Calculated formula: C45 H49 O43.6245
• Title of publication: Switching of polymerization activity of cinnamoyl-α-cyclodextrin
• Authors of publication: Osaki, Motofumi; Takashima, Yoshinori; Yamaguchi, Hiroyasu; Harada, Akira
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2009
• Journal volume: 7
• Journal issue: 8
• Pages of publication: 1646 - 1651
• a: 15.5665 ± 0.0004 Å
• b: 23.5385 ± 0.0005 Å
• c: 33.1929 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12162.3 ± 0.5 ų
• Cell temperature: 100.1 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0698
• Weighted residual factors for all reflections included in the refinement: 0.2154
• Goodness-of-fit parameter for all reflections included in the refinement: 1.134
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No