Information card for entry 7121391

Structure parameters

• Formula: C24 H20 O4
• Calculated formula: C24 H20 O4
• Title of publication: Dynamic kinetic resolution of bis-aryl succinic anhydrides: enantioselective synthesis of densely functionalised γ-butyrolactones.
• Authors of publication: Claveau, Romain; Twamley, Brendan; Connon, Stephen J.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 26
• Pages of publication: 3231 - 3234
• a: 9.36 ± 0.0004 Å
• b: 10.9241 ± 0.0004 Å
• c: 18.8533 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1927.74 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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 all reflections: 0.0311
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0772
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No