Information card for entry 4313006

Structure parameters

• Formula: C16 H16 Mn2 N2 O10
• Calculated formula: C16 H16 Mn2 N2 O10
• Title of publication: Magneto-Structural Correlations in 2D and 3D Extended Structures of Manganese(II)-Malonate Systems
• Authors of publication: Tapas Kumar Maji; Saugata Sain; Golam Mostafa; Tian-Huey Lu; Joan Ribas; Montserrat Monfort; Nirmalendu Ray Chaudhuri
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 709 - 716
• a: 7.2974 ± 0.001 Å
• b: 18.7715 ± 0.001 Å
• c: 7.514 ± 0.003 Å
• α: 90°
• β: 91.743 ± 0.012°
• γ: 90°
• Cell volume: 1028.8 ± 0.4 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.052
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.1393
• Weighted residual factors for all reflections included in the refinement: 0.1431
• Goodness-of-fit parameter for all reflections included in the refinement: 1.121
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No