Information card for entry 7022706

Structure parameters

• Formula: C11 H11 N O5 Sr
• Calculated formula: C11 H11 N O5 Sr
• Title of publication: Comparative study of structures, thermal stabilities and dielectric properties for a ferroelectric MOF [Sr(μ-BDC)(DMF)]∞with its solvent-free framework.
• Authors of publication: Guo, Ping-Chun; Chu, Zhenyu; Ren, Xiao-Ming; Ning, Wei-Hua; Jin, Wanqin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 18
• Pages of publication: 6603 - 6610
• a: 10.6396 ± 0.0003 Å
• b: 10.6396 ± 0.0003 Å
• c: 9.8731 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 967.91 ± 0.05 ų
• Cell temperature: 403 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 144
• Hermann-Mauguin space group symbol: P 31
• Hall space group symbol: P 31
• Residual factor for all reflections: 0.0231
• Residual factor for significantly intense reflections: 0.023
• Weighted residual factors for significantly intense reflections: 0.0636
• Weighted residual factors for all reflections included in the refinement: 0.0636
• Goodness-of-fit parameter for all reflections included in the refinement: 1.148
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No