Information card for entry 7123306

Structure parameters

• Formula: C68 H81 N17 O14 S8
• Calculated formula: C63 H61 N17 O9 S8
• Title of publication: Redox-controlled hybridization of helical foldamers
• Authors of publication: Faour, Lara; Adam, Catherine; Gautier, Christelle; Goeb, Sebastien; Allain, Magali; LEVILLAIN, Eric; Canevet, David; Salle, Marc
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 16.915 ± 0.003 Å
• b: 29.802 ± 0.005 Å
• c: 15.018 ± 0.002 Å
• α: 90°
• β: 90.9 ± 0.015°
• γ: 90°
• Cell volume: 7570 ± 2 ų
• Cell temperature: 120 ± 0.1 K
• Ambient diffraction temperature: 120 ± 0.1 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: 0.2038
• Residual factor for significantly intense reflections: 0.1199
• Weighted residual factors for significantly intense reflections: 0.3202
• Weighted residual factors for all reflections included in the refinement: 0.3892
• Goodness-of-fit parameter for all reflections included in the refinement: 0.937
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No