Information card for entry 7133158

Structure parameters

• Formula: C18 H14 O2
• Calculated formula: C18 H14 O2
• Title of publication: Direct Access to Furan and Cyclopropane Derivatives by Palladium-Catalyzed C-H Activation/Alkenes Insertion/Annulation
• Authors of publication: Zhang, Xu; Chang, Mengfan; Xu, Xuefeng; Zhao, Qiang
• Journal of publication: Chemical Communications
• Year of publication: 2024
• a: 11.2312 ± 0.0004 Å
• b: 14.7726 ± 0.0006 Å
• c: 8.2671 ± 0.0003 Å
• α: 90°
• β: 109.062 ± 0.001°
• γ: 90°
• Cell volume: 1296.42 ± 0.08 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 3
• 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: 0.0508
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.1149
• Weighted residual factors for all reflections included in the refinement: 0.1233
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No