Information card for entry 4341967

Structure parameters

• Formula: C96 H56 Cl3 Mn6.5 N40 O4
• Calculated formula: C96 H48 Cl3 Mn6.5 N40 O4
• Title of publication: A three-dimensional microporous metal-metalloporphyrin framework.
• Authors of publication: Guo, Zhiyong; Yan, Dan; Wang, Hailong; Tesfagaber, Daniel; Li, Xinle; Chen, Yusheng; Huang, Wenyu; Chen, Banglin
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 1
• Pages of publication: 200 - 204
• a: 20.3157 ± 0.0006 Å
• b: 20.3157 ± 0.0006 Å
• c: 19.918 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8220.7 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 123
• Hermann-Mauguin space group symbol: P 4/m m m
• Hall space group symbol: -P 4 2
• Residual factor for all reflections: 0.1023
• Residual factor for significantly intense reflections: 0.0807
• Weighted residual factors for significantly intense reflections: 0.2231
• Weighted residual factors for all reflections included in the refinement: 0.2423
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.41328 Å
• Diffraction radiation type: synchrotronradiation
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No