Information card for entry 7034498

Structure parameters

• Formula: C29 H52 Gd N2 Ni2 O29
• Calculated formula: C29 H52 Gd N2 Ni2 O29
• Title of publication: Ascorbic acid decomposition into oxalate ions: a simple synthetic route towards oxalato-bridged heterometallic 3d-4f clusters.
• Authors of publication: Dinca, Alina S.; Shova, Sergiu; Ion, Adrian E.; Maxim, Catalin; Lloret, Francesc; Julve, Miguel; Andruh, Marius
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 16
• Pages of publication: 7148 - 7151
• a: 23.7331 ± 0.0011 Å
• b: 17.0913 ± 0.0006 Å
• c: 25.6958 ± 0.0014 Å
• α: 90°
• β: 110.935 ± 0.006°
• γ: 90°
• Cell volume: 9734.9 ± 0.9 ų
• Cell temperature: 199.8 ± 0.4 K
• Ambient diffraction temperature: 199.8 ± 0.4 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: 0.1213
• Residual factor for significantly intense reflections: 0.0732
• Weighted residual factors for significantly intense reflections: 0.1642
• Weighted residual factors for all reflections included in the refinement: 0.1929
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No