Information card for entry 2008181

Structure parameters

• Common name: Potassium 2,4-dichloro-6-nitrophenolate
• Chemical name: potassium 2,4-dichloro-6-nitrophenolate
• Formula: C6 H2 Cl2 K N O3
• Calculated formula: C6 H2 Cl2 K N O3
• SMILES: [K+].Clc1cc(cc(N(=O)=O)c1[O-])Cl
• Title of publication: Potassium 2,4-dichloro-6-nitrophenolate
• Authors of publication: Vasiliev, Alexander D.; Solovyov, Leonid A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 2
• Pages of publication: IUC9900004
• a: 14.84 ± 0.001 Å
• b: 7.0447 ± 0.0007 Å
• c: 4.2585 ± 0.0004 Å
• α: 81.292 ± 0.008°
• β: 84.988 ± 0.008°
• γ: 84.837 ± 0.008°
• Cell volume: 437.05 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.053
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for all reflections included in the refinement: 0.13
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 1.54051 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No