Information card for entry 4021851

Structure parameters

• Formula: C24 H16 O2
• Calculated formula: C24 H16 O2
• SMILES: O1c2ccccc2c2ccccc2Oc2ccccc2c2ccccc12
• Title of publication: Efficient Construction of Biaryls and Macrocyclic Cyclophanes via Electron-Transfer Oxidation of Lipshutz Cuprates
• Authors of publication: Yoshihiro Miyake; Mo Wu; M. Jalilur Rahman; Yoshiyuki Kuwatani; Masahiko Iyoda
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2006
• Journal volume: 71
• Pages of publication: 6110 - 6117
• a: 11.358 ± 0.002 Å
• b: 15.466 ± 0.004 Å
• c: 9.749 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1712.5 ± 0.6 ų
• Cell temperature: 298.2 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 significantly intense reflections: 0.0606
• Weighted residual factors for all reflections included in the refinement: 0.2111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.932
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No