Information card for entry 2215544

Structure parameters

• Chemical name: 2-Hydroxy-5-nitrobenzene-1,3-dicarboxylic acid monohydrate
• Formula: C8 H7 N O8
• Title of publication: 2-Hydroxy-5-nitrobenzene-1,3-dicarboxylic acid monohydrate
• Authors of publication: Zhong, H.; Yang, X.-M.; Xie, H.-L.; Luo, C.-J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 10
• Pages of publication: o4191
• a: 25.21 ± 0.02 Å
• b: 6.5072 ± 0.0016 Å
• c: 12.331 ± 0.002 Å
• α: 90°
• β: 112.019 ± 0.004°
• γ: 90°
• Cell volume: 1875.3 ± 1.6 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0949
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.1307
• Weighted residual factors for all reflections included in the refinement: 0.1476
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: No
• Has disorder: No
• Has Fobs: No