Information card for entry 4335535

Structure parameters

• Formula: C212 H129 Cl28 Dy2 N20 O16
• Calculated formula: C212 H124 Cl28 Dy2 N20 O16
• Title of publication: Sandwich-Type Mixed Tetrapyrrole Rare-Earth Triple-Decker Compounds. Effect of the Coordination Geometry on the Single-Molecule-Magnet Nature
• Authors of publication: Jinglan Kan; Hailong Wang; Wei Sun; Wei Cao; Jun Tao; Jianzhuang Jiang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 8505 - 8510
• a: 24.4126 ± 0.0002 Å
• b: 24.4126 ± 0.0002 Å
• c: 18.0724 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10770.7 ± 0.3 ų
• Cell temperature: 126 ± 9 K
• Ambient diffraction temperature: 126 ± 9 K
• Number of distinct elements: 6
• Space group number: 104
• Hermann-Mauguin space group symbol: P 4 n c
• Hall space group symbol: P 4 -2n
• Residual factor for all reflections: 0.0774
• Residual factor for significantly intense reflections: 0.067
• Weighted residual factors for significantly intense reflections: 0.1934
• Weighted residual factors for all reflections included in the refinement: 0.2032
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No