Information card for entry 8100121

Structure parameters

• Formula: C13 H16 N2 O6
• Calculated formula: C13 H16 N2 O6
• Title of publication: Crystal structure of diethyl rel-(3aR,3bR,6aS,7aR)-3b,6a,7,7a-tetrahydro- 3aH-cyclopenta-[1,2-d:3,4-d']-diisoxazole-3,6-dicarboxylate, C~13~H~16~N~2~O~6~
• Authors of publication: Frey, Wolfgang; Lee, Ja Young; Jäger, Volker
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2004
• Journal volume: 219
• Journal issue: 3
• Pages of publication: 289 - 290
• a: 9.8365 ± 0.0006 Å
• b: 12.0017 ± 0.0005 Å
• c: 23.9197 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2823.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No