Information card for entry 7200539

Structure parameters

• Formula: C26 H18 Mn2 N2 O11 S6
• Calculated formula: C26 H18 Mn2 N2 O11 S6
• Title of publication: Influence of co-ligands and solvents on the packing and photoluminescence of three related MnII metal‒organic frameworks
• Authors of publication: Wang, Sujing; Xiong, Shunshun; Song, Lexin; Wang, Zhiyong
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 5
• Pages of publication: 896 - 901
• a: 11.0311 ± 0.0004 Å
• b: 11.5197 ± 0.0005 Å
• c: 27.033 ± 0.001 Å
• α: 90°
• β: 100.739 ± 0.004°
• γ: 90°
• Cell volume: 3375.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0342
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for significantly intense reflections: 0.0889
• Weighted residual factors for all reflections included in the refinement: 0.0903
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No