Information card for entry 4305787

Structure parameters

• Formula: C5 H4 Mg N2 O5
• Calculated formula: C5 H4 Mg N2 O5
• Title of publication: Temperature- and Stoichiometry-Controlled Dimensionality in a Magnesium 4,5-Imidazoledicarboxylate System with Strong Hydrophilic Pore Surfaces
• Authors of publication: K. L. Gurunatha; Kazuhiro Uemura; Tapas Kumar Maji
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 6578 - 6580
• a: 7.0347 ± 0.0002 Å
• b: 7.4802 ± 0.0002 Å
• c: 7.3586 ± 0.0003 Å
• α: 90°
• β: 117.965 ± 0.001°
• γ: 90°
• Cell volume: 342 ± 0.02 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0308
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0733
• Weighted residual factors for all reflections included in the refinement: 0.0744
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No