Information card for entry 7124072

Structure parameters

• Formula: C27 H24 Cl N3 O4
• Calculated formula: C27 H24 Cl N3 O4
• Title of publication: Organocatalytic Diastereoselective [3+2] Cyclization of MBH Carbonates with Dinucleophiles: Synthesis of Bicyclic Imidazoline Derivatives that Inhibit MDM2-p53 Interaction
• Authors of publication: Zhu, Hong-Ping; Xie, Ke; He, Xiang-Hong; Huang, Wei; Zeng, Rong; Fan, Yang; Peng, Cheng; He, Gu; Han, Bo
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 10.62565 ± 0.00016 Å
• b: 10.62565 ± 0.00016 Å
• c: 43.3437 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4893.7 ± 0.2 ų
• Cell temperature: 293.9 ± 0.3 K
• Ambient diffraction temperature: 293.9 ± 0.3 K
• Number of distinct elements: 5
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.0682
• Residual factor for significantly intense reflections: 0.0647
• Weighted residual factors for significantly intense reflections: 0.1701
• Weighted residual factors for all reflections included in the refinement: 0.1743
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No