Information card for entry 8100249

Structure parameters

• Formula: C7 H8 N2 O3 S
• Calculated formula: C7 H8 N2 O3 S
• SMILES: S1C(C(=O)N=C1N)=CC(=O)OCC
• Title of publication: Crystal structure of ethyl Z-2-[2-amino-4-oxo-1,3-thiazol-5(4H)-yliden]- acetate, C~7~H~8~N~2~O~3~S
• Authors of publication: Ramazani, Ali; Morsali, Ali; Soudi, Ali Akbar; Souldozi, Ali; Starikova, Z. A.; Yanovsky, Alex
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2003
• Journal volume: 218
• Journal issue: 1
• Pages of publication: 33 - 34
• a: 4.1057 ± 0.0009 Å
• b: 10.394 ± 0.002 Å
• c: 11 ± 0.002 Å
• α: 84.455 ± 0.004°
• β: 72.175 ± 0.002°
• γ: 67.277 ± 0.002°
• Cell volume: 412.09 ± 0.15 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• 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