Information card for entry 7718030

Structure parameters

• Formula: C80 H148 Gd4 N8 Ni8 O60
• Calculated formula: C80 H100 Gd4 N8 Ni8 O36
• Title of publication: Dodecanuclear [NiII8Ln₄] clusters and rings of corner-sharing {NiII2Ln₂} cubanes (Ln = Dy, Gd, Y); magnetic and magnetothermal properties.
• Authors of publication: Tziotzi, Thomais G.; Agapaki, Eleftheria; Charkiolakis, Emmanouil K.; Gracia, David; Ubach I Cervera, Marc; Dalgarno, Scott J.; Evangelisti, Marco; Brechin, Euan K.; Milios, Constantinos J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 11
• Pages of publication: 4664 - 4671
• a: 20.9663 ± 0.001 Å
• b: 20.0465 ± 0.0009 Å
• c: 26.2609 ± 0.0013 Å
• α: 90°
• β: 101.119 ± 0.002°
• γ: 90°
• Cell volume: 10830.3 ± 0.9 ų
• Cell temperature: 210 ± 2 K
• Ambient diffraction temperature: 210 ± 2 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: 0.0613
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.117
• Weighted residual factors for all reflections included in the refinement: 0.1225
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No