Information card for entry 4334430

Structure parameters

• Formula: C8 H8 Mn N4 O5
• Calculated formula: C8 H8 Mn N4 O5
• Title of publication: Manganese(II), Iron(II), and Mixed-Metal Metal-Organic Frameworks Based on Chains with Mixed Carboxylate and Azide Bridges: Magnetic Coupling and Slow Relaxation
• Authors of publication: Yan-Qin Wang; Qi Yue; Yan Qi; Kun Wang; Qian Sun; En-Qing Gao
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 4259 - 4268
• a: 7.6413 ± 0.0007 Å
• b: 7.566 ± 0.0007 Å
• c: 18.1056 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1046.76 ± 0.16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.1075
• Residual factor for significantly intense reflections: 0.0683
• Weighted residual factors for significantly intense reflections: 0.198
• Weighted residual factors for all reflections included in the refinement: 0.2167
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No