Information card for entry 7131517

Structure parameters

• Formula: C228 H230 Cl12 N32 Na2 O40
• Calculated formula: C228 H78 Cl12 N32 Na2 O40
• Title of publication: Coaxial assembly of helical aromatic foldamers by metal coordination.
• Authors of publication: Galan, Albano; Lulic, Kristijan; Wang, Jingqi; Wicher, Barbara; Huc, Ivan; Duhamel, Jean; Maurizot, Victor
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 35
• Pages of publication: 5253 - 5256
• a: 44.863 ± 0.014 Å
• b: 19.062 ± 0.005 Å
• c: 28.749 ± 0.009 Å
• α: 90°
• β: 106.137 ± 0.007°
• γ: 90°
• Cell volume: 23617 ± 12 ų
• Cell temperature: 100.15 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 6
• 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: 0.2416
• Residual factor for significantly intense reflections: 0.1931
• Weighted residual factors for significantly intense reflections: 0.472
• Weighted residual factors for all reflections included in the refinement: 0.5113
• Goodness-of-fit parameter for all reflections included in the refinement: 1.673
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No