Information card for entry 4020733

Structure parameters

• Formula: C16 H17 Br O3
• Calculated formula: C16 H17 Br O3
• SMILES: Brc1ccc([C@H]([C@@H](O)c2ccc(OC)cc2)CO)cc1
• Title of publication: Asymmetric Intermolecular C-H Functionalization of Benzyl Silyl Ethers Mediated by Chiral Auxiliary-Based Aryldiazoacetates and Chiral Dirhodium Catalysts
• Authors of publication: Huw M. L. Davies; Simon J. Hedley; Brooks R. Bohall
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 10737 - 10742
• a: 5.0172 ± 0.0003 Å
• b: 11.8925 ± 0.0006 Å
• c: 24.7383 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1476.06 ± 0.14 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 1 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No