Information card for entry 4513097

Structure parameters

• Formula: C76 H68 Er4 N16 O40 S8
• Calculated formula: C76 H68 Er4 N16 O40 S8
• Title of publication: Hydrothermal Syntheses, Crystal Structures, and Luminescence Properties of Lanthanide-Based Coordination Polymers Constructed by Sulfonate Functionalized Imidazophenanthroline Derivative Ligand
• Authors of publication: Xu, Bing; Chen, Qing; Hu, Huai-Ming; An, Ran; Wang, Xiaofang; Xue, Ganglin
• Journal of publication: Crystal Growth & Design
• Year of publication: 2015
• Journal volume: 15
• Journal issue: 5
• Pages of publication: 2318
• a: 10.4411 ± 0.0008 Å
• b: 6.9518 ± 0.0006 Å
• c: 30.305 ± 0.002 Å
• α: 90°
• β: 96.522 ± 0.001°
• γ: 90°
• Cell volume: 2185.4 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0354
• Residual factor for significantly intense reflections: 0.0292
• Weighted residual factors for significantly intense reflections: 0.0613
• Weighted residual factors for all reflections included in the refinement: 0.0638
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No