Information card for entry 7213321

Structure parameters

• Formula: C11 H10 O4
• Calculated formula: C11 H10 O4
• Title of publication: Polystyrene and polymethacrylate resin-supported Jacobsen’s alkene epoxidation catalyst
• Authors of publication: Canali, Laetitia; Cowan, Elaine; Deleuze, Hervé; Gibson, Colin L.; Sherrington, David C.
• Journal of publication: Journal of the Chemical Society, Perkin Transactions 1
• Year of publication: 2000
• Journal issue: 13
• Pages of publication: 2055
• a: 6.667 ± 0.002 Å
• b: 7.607 ± 0.003 Å
• c: 10.567 ± 0.004 Å
• α: 73.34 ± 0.03°
• β: 86.35 ± 0.03°
• γ: 75.58 ± 0.03°
• Cell volume: 497.2 ± 0.3 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.044
• Residual factor for significantly intense reflections: 0.0333
• Weighted residual factors for all reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.0501
• Goodness-of-fit parameter for significantly intense reflections: 1.908
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKalpha
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No