Information card for entry 8100849

Structure parameters

• Formula: C18 H21 N O7
• Calculated formula: C18 H21 N O7
• Title of publication: Crystal structure of (3aS,4R,5S,6R,6aS)-4,5,6-triacetoxy-1-phenyl- 3,3a,4,5,6,6a-hexahydro-1H-cyclo-pent[c]-isoxazole, C~18~H~21~NO~7~
• Authors of publication: Frey, Wolfgang; Hilgers, Petra; Jäger, Volker
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2001
• Journal volume: 216
• Journal issue: 1
• Pages of publication: 93 - 94
• a: 9.5652 ± 0.0011 Å
• b: 7.5975 ± 0.0011 Å
• c: 12.4961 ± 0.0014 Å
• α: 90°
• β: 90.552 ± 0.009°
• γ: 90°
• Cell volume: 908.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0853
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No