Information card for entry 7707894

Structure parameters

• Formula: C66 H76 N2 Ni2 O22 Tb2
• Calculated formula: C66 H76 N2 Ni2 O22 Tb2
• Title of publication: Synthesis, characterization, magnetism and theoretical analysis of hetero-metallic [Ni₂Ln₂] partial di-cubane assemblies.
• Authors of publication: Bhanja, Avik; Herchel, Radovan; Moreno-Pineda, Eufemio; Khara, Anjan; Wernsdorfer, Wolfgang; Ray, Debashis
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 36
• Pages of publication: 12517 - 12527
• a: 11.272 ± 0.01 Å
• b: 11.493 ± 0.012 Å
• c: 13.955 ± 0.012 Å
• α: 78.47 ± 0.02°
• β: 76.06 ± 0.02°
• γ: 89.62 ± 0.04°
• Cell volume: 1718 ± 3 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0455
• Residual factor for significantly intense reflections: 0.0273
• Weighted residual factors for significantly intense reflections: 0.0587
• Weighted residual factors for all reflections included in the refinement: 0.0651
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No