Information card for entry 7704421

Structure parameters

• Formula: C80 H108 N5 Ni5 O46 Tb3
• Calculated formula: C80 H106 N5 Ni5 O46 Tb3
• Title of publication: Self-assembled octanuclear [Ni₅Ln₃] (Ln = Dy, Tb and Ho) complexes: synthesis, coordination induced ligand hydrolysis, structure and magnetism.
• Authors of publication: Bhanja, Avik; Moreno-Pineda, Eufemio; Herchel, Radovan; Wernsdorfer, Wolfgang; Ray, Debashis
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 23
• Pages of publication: 7968 - 7976
• a: 22.194 ± 0.003 Å
• b: 23.629 ± 0.003 Å
• c: 20.418 ± 0.003 Å
• α: 90°
• β: 96.094 ± 0.004°
• γ: 90°
• Cell volume: 10647 ± 3 ų
• Cell temperature: 114.51 K
• Ambient diffraction temperature: 114.51 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0798
• Residual factor for significantly intense reflections: 0.0662
• Weighted residual factors for significantly intense reflections: 0.177
• Weighted residual factors for all reflections included in the refinement: 0.197
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No