Information card for entry 7700768

Structure parameters

• Formula: C126 H90 Co6 O40 Zn7
• Calculated formula: C126 H90 Co6 O40 Zn7
• Title of publication: Synthesis, structure and magnetic properties of a novel high-nuclearity oxo-carboxylate [Zn_xCo_13-x(μ₄-O)₄(O₂CPh)₁₈] cluster.
• Authors of publication: Nawrocki, Jan; Prochowicz, Daniel; Justyniak, Iwona; van Leusen, Jan; Kornowicz, Arkadiusz; Kögerler, Paul; Lewiński, Janusz
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 34
• Pages of publication: 12828 - 12831
• a: 22.1339 ± 0.0005 Å
• b: 22.1339 ± 0.0005 Å
• c: 26.645 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 11304.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :H
• Hall space group symbol: R 3
• Residual factor for all reflections: 0.0682
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1351
• Weighted residual factors for all reflections included in the refinement: 0.1471
• 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: No
• Has Fobs: No