Information card for entry 7040488

Structure parameters

• Formula: C56 H38 N4 O25 Pr2 S2
• Calculated formula: C56 H38 N4 O25 Pr2 S2
• Title of publication: Lanthanide coordination frameworks constructed from 3,3',4,4'-diphenylsulfonetetracarboxylic and 1,10-phenanthroline: synthesis, crystal structures and luminescence properties.
• Authors of publication: Li, Chuan-Ti; Zhao, Yi-Fan; Hu, Huai-Ming; Zhao, Hui; Wang, Xiaofang; Xue, Ganglin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 39
• Pages of publication: 15436
• a: 10.5654 ± 0.0017 Å
• b: 11.668 ± 0.002 Å
• c: 12.0378 ± 0.0019 Å
• α: 109.547 ± 0.003°
• β: 105.454 ± 0.003°
• γ: 90.547 ± 0.003°
• Cell volume: 1339.9 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0697
• Residual factor for significantly intense reflections: 0.0578
• Weighted residual factors for significantly intense reflections: 0.109
• Weighted residual factors for all reflections included in the refinement: 0.1145
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No