Information card for entry 4336196

Structure parameters

• Formula: C43 H51.5 Cl2 Co Ho N2 O11.25 P3 S6
• Calculated formula: C43 H51.5 Cl2 Co Ho N2 O11.25 P3 S6
• Title of publication: Seven-Coordinate Lanthanide Sandwich-Type Complexes with a Tetrathiafulvalene-Fused Schiff Base Ligand
• Authors of publication: Feng Gao; Long Cui; Wei Liu; Liang Hu; Yu-Wu Zhong; Yi-Zhi Li; Jing-Lin Zuo
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 11164 - 11172
• a: 14.9021 ± 0.0019 Å
• b: 20.1141 ± 0.0011 Å
• c: 20.2924 ± 0.0015 Å
• α: 90°
• β: 105.571 ± 0.004°
• γ: 90°
• Cell volume: 5859.3 ± 0.9 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 9
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0604
• Residual factor for significantly intense reflections: 0.0524
• Weighted residual factors for significantly intense reflections: 0.1351
• Weighted residual factors for all reflections included in the refinement: 0.137
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No