Information card for entry 4332645

Structure parameters

• Formula: C154 H482 Cl20 Cu49 N26 O313 Sm12
• Calculated formula: C154 H300 Cl20 Cu49 N26 O313 Sm12
• Title of publication: Syntheses, Structures, and Properties of High-Nuclear 3d−4f Clusters with Amino Acid as Ligand: {Gd6Cu24}, {Tb6Cu26}, and {(Ln6Cu24)2Cu} (Ln= Sm, Gd)
• Authors of publication: Zhang, Jian-Jun; Hu, Sheng-Min; Xiang, Sheng-Chang; Sheng, Tianlu; Wu, Xin-Tao; Li, Ya-Min
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 18
• Pages of publication: 7173 - 7181
• a: 30.1194 ± 0.001 Å
• b: 27.7611 ± 0.001 Å
• c: 29.2933 ± 0.001 Å
• α: 90°
• β: 93.434 ± 0.001°
• γ: 90°
• Cell volume: 24449.5 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for significantly intense reflections: 0.0869
• Weighted residual factors for significantly intense reflections: 0.2169
• Weighted residual factors for all reflections included in the refinement: 0.3228
• Goodness-of-fit parameter for significantly intense reflections: 1.141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.163
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No