Information card for entry 8105364

Structure parameters

• Formula: C36 H40 Mn N4 O16
• Calculated formula: C36 H40 Mn N4 O16
• Title of publication: The crystal structure of poly[bis(N,N-dimethylformamide-κ1 O)(μ4- 2′,5,5′,5′′-tetracarboxy-[1,1′:4′,1′′-terphenyl]-3,3′′-dicarboxylato-κ4 O:O′:O′′:O′′′)manganese(II)] — N,N-dimethylformamide (1/2), C36H40N4O16Mn
• Authors of publication: Li, Guoqiang; Chen, Guo; Liu, Yanping; Wang, Gao; Liu, Liyu
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 5
• Pages of publication: 1015 - 1017
• a: 10.5247 ± 0.0011 Å
• b: 19.0823 ± 0.0019 Å
• c: 10.5502 ± 0.0011 Å
• α: 90°
• β: 112.641 ± 0.002°
• γ: 90°
• Cell volume: 1955.6 ± 0.3 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 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: 0.0934
• Residual factor for significantly intense reflections: 0.0619
• Weighted residual factors for significantly intense reflections: 0.1601
• Weighted residual factors for all reflections included in the refinement: 0.1741
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No