Information card for entry 2000074

Structure parameters

• Formula: C26 H19 N O4
• Calculated formula: C56 H32 N4 O12
• Title of publication: Solid-State Isomerization of Atropodiastereomers: Effective Diastereoselection through Polymorphic Transformations
• Authors of publication: Einhorn, Cathy; Durif, André; Averbuch, Marie-Thérèse; Einhorn, Jacques
• Journal of publication: Angewandte Chemie, International Edition in English
• Year of publication: 2001
• Journal volume: 40
• Journal issue: 10
• Pages of publication: 1926 - 1929
• a: 10.948 ± 0.002 Å
• b: 8.269 ± 0.003 Å
• c: 11.165 ± 0.003 Å
• α: 90°
• β: 90.98 ± 0.02°
• γ: 90°
• Cell volume: 1010.61 ų
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.065
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No