Information card for entry 2001254

Structure parameters

• Chemical name: 4-Chloro-N-(2,5-dihydro-5-oxo-2-furanyl)benzamide
• Formula: C11 H8 Cl N O3
• Calculated formula: C11 H8 Cl N O3
• SMILES: Clc1ccc(C(=O)NC2OC(=O)C=C2)cc1
• Title of publication: Structure du 4-chloro-<i>N</i>-(2,5-dihydro-5-oxo-2-furyl)benzamide, C~11~H~8~CINO~3~
• Authors of publication: Ginderow, D.; Valla, A.; Giraud, M.; Michaïlidis, A.; Labia, R.; Morand, A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 11
• Pages of publication: 2012 - 2013
• a: 6.541 ± 0.003 Å
• b: 29.591 ± 0.012 Å
• c: 5.72 ± 0.002 Å
• α: 90°
• β: 108.33 ± 0.04°
• γ: 90°
• Cell volume: 1051 ± 0.8 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• 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: 0.067
• Weighted residual factors for significantly intense reflections: 0.073
• Goodness-of-fit parameter for significantly intense reflections: 1.353
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No