Information card for entry 4315192

Structure parameters

• Formula: C160 H130 Gd5 N5 O25
• Calculated formula: C160 H125 Gd5 N5 O25
• Title of publication: Metal-Controlled Assembly of Near-Infrared-Emitting Pentanuclear Lanthanide β-Diketone Clusters
• Authors of publication: Xiao-Yan Chen; Xiaoping Yang; Bradley J. Holliday
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 2583 - 2585
• a: 17.3255 ± 0.0004 Å
• b: 22.8866 ± 0.0004 Å
• c: 36.0945 ± 0.0006 Å
• α: 79.124 ± 0.002°
• β: 88.817 ± 0.003°
• γ: 89.353 ± 0.003°
• Cell volume: 14051.8 ± 0.5 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1671
• Residual factor for significantly intense reflections: 0.0871
• Weighted residual factors for significantly intense reflections: 0.1131
• Weighted residual factors for all reflections included in the refinement: 0.1264
• Goodness-of-fit parameter for all reflections included in the refinement: 1.406
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No