Information card for entry 7105320

Structure parameters

• Formula: C43 H48 B4 Cl2 Dy2 N26 O4
• Calculated formula: C43 H48 B4 Cl2 Dy2 N26 O4
• Title of publication: A promising new route towards single-molecule magnets based on the oxalate ligand.
• Authors of publication: Xu, Gong-Feng; Wang, Qing-Lun; Gamez, Patrick; Ma, Yue; Clérac, Rodolphe; Tang, Jinkui; Yan, Shi-Ping; Cheng, Peng; Liao, Dai-Zheng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 9
• Pages of publication: 1506 - 1508
• a: 14.8862 ± 0.0003 Å
• b: 14.8862 ± 0.0003 Å
• c: 24.7887 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5493.1 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.0213
• Residual factor for significantly intense reflections: 0.0182
• Weighted residual factors for significantly intense reflections: 0.0444
• Weighted residual factors for all reflections included in the refinement: 0.056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.168
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No