Information card for entry 4316144

Structure parameters

• Formula: C12 H16 Mn3 N4 O17
• Calculated formula: C12 H16 Mn3 N4 O17
• Title of publication: Thermally Triggered Reversible Transformation between Parallel Staggered Stacking and Plywood-Like Stacking of 1D Coordination Polymer Chains
• Authors of publication: Jian-Ke Sun; Xu-Hui Jin; Chao Chen; Jie Zhang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 7046 - 7051
• a: 15.621 ± 0.002 Å
• b: 10.6503 ± 0.0009 Å
• c: 12.1608 ± 0.0014 Å
• α: 90°
• β: 92.451 ± 0.01°
• γ: 90°
• Cell volume: 2021.3 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0374
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0824
• Weighted residual factors for all reflections included in the refinement: 0.0861
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No