Information card for entry 2220338

Structure parameters

• Chemical name: Poly[potassium-μ-2-[2-(carboxymethyl)phenyl]acetato]
• Formula: C10 H9 K O4
• Calculated formula: C10 H9 K O4
• SMILES: [K+].O=C([O-])Cc1c(cccc1)CC(=O)O
• Title of publication: Poly[potassium-μ-2-[2-(carboxymethyl)phenyl]acetato]
• Authors of publication: García-Zarracino, Reyes; Rangel-Marrón, Marcela; Tlahuext, Hugo; Höpfl, Herbert
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: m1626
• a: 8.3365 ± 0.0014 Å
• b: 6.7886 ± 0.0011 Å
• c: 17.651 ± 0.003 Å
• α: 90°
• β: 92.543 ± 0.003°
• γ: 90°
• Cell volume: 997.9 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0461
• Residual factor for significantly intense reflections: 0.0407
• Weighted residual factors for significantly intense reflections: 0.0974
• Weighted residual factors for all reflections included in the refinement: 0.1011
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes