Information card for entry 7043969

Structure parameters

• Formula: C81 H100 F24 N10 O7
• Calculated formula: C81 H100 F24 N10 O7
• Title of publication: Systematic Size Mediated Trapping of Anions of Varied Dimensionality within Dimeric Capsular Assembly of a Flexible Neutral Bis-Urea Platform
• Authors of publication: Manna, Utsab; Kayal, Santanu; Nayak, Biswajit; Das, Gopal
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 8.6918 ± 0.0006 Å
• b: 24.9364 ± 0.0016 Å
• c: 40.194 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8711.7 ± 1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.1402
• Residual factor for significantly intense reflections: 0.0811
• Weighted residual factors for significantly intense reflections: 0.1716
• Weighted residual factors for all reflections included in the refinement: 0.2046
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No