Information card for entry 7706821

Structure parameters

• Formula: C65 H95 Gd2 N4 Ni6 O38
• Calculated formula: C65 H79 Gd2 N4 Ni6 O30
• Title of publication: Hydroxido supported and differently networked octanuclear Ni₆Ln₂ [Ln = Gd^III and Dy^III] complexes: structural variation, magnetic properties and theoretical insights.
• Authors of publication: Bhanja, Avik; Smythe, Lucy; Herchel, Radovan; Nemec, Ivan; Murrie, Mark; Ray, Debashis
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 14
• Pages of publication: 5023 - 5035
• a: 11.53 ± 0.02 Å
• b: 14.72 ± 0.02 Å
• c: 15.378 ± 0.019 Å
• α: 113.93 ± 0.02°
• β: 103.87 ± 0.06°
• γ: 102.08 ± 0.05°
• Cell volume: 2174 ± 6 ų
• Cell temperature: 114 ± 2 K
• Ambient diffraction temperature: 114.15 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: 0.0966
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.1154
• Weighted residual factors for all reflections included in the refinement: 0.1445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No