Information card for entry 7020703

Structure parameters

• Formula: C39.75 H27.25 N6 O10 Zn4
• Calculated formula: C39.75 H27.25 N6 O10 Zn4
• Title of publication: Unsymmetrical octanuclear Schiff base clusters: synthesis, characterization and catalysis.
• Authors of publication: Kielland, Nicola; Escudero-Adán, Eduardo C; Martínez Belmonte, Marta; Kleij, Arjan W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 5
• Pages of publication: 1427 - 1436
• a: 57.3214 ± 0.0015 Å
• b: 57.3214 ± 0.0015 Å
• c: 15.4613 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 43996 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0766
• Residual factor for significantly intense reflections: 0.0643
• Weighted residual factors for significantly intense reflections: 0.1724
• Weighted residual factors for all reflections included in the refinement: 0.1815
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No