Information card for entry 4020231

Structure parameters

• Formula: C10 H13 N O4
• Calculated formula: C10 H13 N O4
• SMILES: N1C(C(=O)C(=C(C1=O)C)C(=O)OC)(C)C
• Authors of publication: Alessia Bacchi; Mirco Costa; Nicola Della Cà; Bartolo Gabriele; Giuseppe Salerno; Silvia Cassoni
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 4971 - 4979
• a: 13.914 ± 0.003 Å
• b: 6.448 ± 0.002 Å
• c: 6.075 ± 0.002 Å
• α: 100.19 ± 0.02°
• β: 97.74 ± 0.02°
• γ: 87.12 ± 0.02°
• Cell volume: 531.4 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No