Information card for entry 4340048

Structure parameters

• Formula: C175.5 H167 Cl0.75 Dy2 N31.25 O30.5 Zn9
• Calculated formula: C175.5 H136.5 Cl0.75 Dy2 N31.25 O33.5 Zn9
• Title of publication: Solvent dependent assembly of lanthanide metallacrowns using building blocks with incompatible symmetry preferences.
• Authors of publication: Jankolovits, Joseph; Kampf, Jeff W.; Pecoraro, Vincent L.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 14
• Pages of publication: 7534 - 7546
• a: 20.445 ± 0.005 Å
• b: 21.83 ± 0.005 Å
• c: 22.271 ± 0.005 Å
• α: 93.512 ± 0.005°
• β: 102.15 ± 0.005°
• γ: 113.693 ± 0.005°
• Cell volume: 8779 ± 4 ų
• Cell temperature: 85 ± 2 K
• Ambient diffraction temperature: 85 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0794
• Residual factor for significantly intense reflections: 0.0718
• Weighted residual factors for significantly intense reflections: 0.2058
• Weighted residual factors for all reflections included in the refinement: 0.2148
• Goodness-of-fit parameter for all reflections included in the refinement: 1.187
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No