Information card for entry 4345226

Structure parameters

• Formula: C194 H167 Cl10 Eu4 N27 O91
• Calculated formula: C194 H167 Cl10 Eu4 N27 O91
• Title of publication: Functionalized Triptycene-Derived Tripodal Ligands: Privileged Formation of Tetranuclear Cage Assemblies with Larger Ln(III)
• Authors of publication: Vuillamy, Alexandra; Zebret, Soumaila; Besnard, Céline; Placide, Virginie; Petoud, Stéphane; Hamacek, Josef
• Journal of publication: Inorganic Chemistry
• Year of publication: 2017
• a: 37.8968 ± 0.0003 Å
• b: 37.8968 ± 0.0003 Å
• c: 37.8968 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 54426.2 ± 0.7 ų
• Cell temperature: 180 K
• Ambient diffraction temperature: 180 K
• Number of distinct elements: 6
• Space group number: 205
• Hermann-Mauguin space group symbol: P a -3
• Hall space group symbol: -P 2ac 2ab 3
• Residual factor for all reflections: 0.1308
• Residual factor for significantly intense reflections: 0.0909
• Weighted residual factors for significantly intense reflections: 0.2181
• Weighted residual factors for all reflections included in the refinement: 0.2487
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No