Information card for entry 4020783

Structure parameters

• Formula: C10 H8 Br2 O2
• Calculated formula: C10 H8 Br2 O2
• SMILES: BrC1=C(Br)[C@@](O)(C#CC)[C@H]2O[C@@H]1C=C2.BrC1=C(Br)[C@](O)(C#CC)[C@@H]2O[C@H]1C=C2
• Title of publication: Bicyclo[3.2.1]octane Synthons from Cyclopropenes: Functionalization of Cycloadducts by Nucleophilic Additions
• Authors of publication: Ravi S. Orugunty; Dennis L. Wright; Merle A. Battiste; Richard J. Helmich; Khalil Abboud
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 406 - 416
• a: 11.7974 ± 0.0006 Å
• b: 8.1389 ± 0.0004 Å
• c: 11.4455 ± 0.0005 Å
• α: 90°
• β: 98.719 ± 0.002°
• γ: 90°
• Cell volume: 1086.27 ± 0.09 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No