Information card for entry 7227362

Structure parameters

• Chemical name: Ethenzamide-24Dihydroxybenzoic acid
• Formula: C16 H16 N O6
• Calculated formula: C16 H16 N O6
• Title of publication: Crystal structure landscape of ethenzamide: a physicochemical property study
• Authors of publication: Sarmah, Kashyap Kumar; Boro, Kaveri; Arhangelskis, Mihails; Thakuria, Ranjit
• Journal of publication: CrystEngComm
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 5
• Pages of publication: 826
• a: 9.6638 ± 0.0017 Å
• b: 6.6901 ± 0.0011 Å
• c: 24.67 ± 0.004 Å
• α: 90°
• β: 99.732 ± 0.008°
• γ: 90°
• Cell volume: 1572 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0729
• Residual factor for significantly intense reflections: 0.0449
• Weighted residual factors for significantly intense reflections: 0.136
• Weighted residual factors for all reflections included in the refinement: 0.1627
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No