Information card for entry 7044218

Structure parameters

• Formula: C73.35 H130.69 B6 Cl2 N24 O30 Y4
• Calculated formula: C73.344 H130.688 B6 Cl1.998 N24 O30 Y4
• Title of publication: Slow magnetisation relaxation in tetraoxolene-bridged rare-earth complexes
• Authors of publication: Dunstan, Maja; Rousset, Elodie; Boulon, Marie-Emmanuelle; Gable, Robert William; Sorace, Lorenzo; Boskovic, Colette
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 13.1868 ± 0.0003 Å
• b: 21.4815 ± 0.0004 Å
• c: 19.6434 ± 0.0004 Å
• α: 90°
• β: 101.213 ± 0.0018°
• γ: 90°
• Cell volume: 5458.2 ± 0.2 ų
• Cell temperature: 130.01 ± 0.1 K
• Ambient diffraction temperature: 130.01 ± 0.1 K
• Number of distinct elements: 7
• 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: 0.0624
• Residual factor for significantly intense reflections: 0.0558
• Weighted residual factors for significantly intense reflections: 0.1444
• Weighted residual factors for all reflections included in the refinement: 0.1502
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No