Information card for entry 4346281

Structure parameters

• Formula: C131.2 H223.2 Cu4 Gd8 N9.4 O53.1
• Calculated formula: C131.2 H210 Cu4 Gd8 N9.4 O53.1
• Title of publication: Nonemployed Simple Carboxylate Ions in Well-Investigated Areas of Heterometallic Carboxylate Cluster Chemistry: A New Family of {Cu(II)4Ln(III)8} Complexes Bearing tert-Butylacetate Bridging Ligands.
• Authors of publication: Dermitzaki, Despina; Raptopoulou, Catherine P.; Psycharis, Vassilis; Escuer, Albert; Perlepes, Spyros P.; Stamatatos, Theocharis C.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 15
• Pages of publication: 7555 - 7561
• a: 16.1708 ± 0.0003 Å
• b: 17.2594 ± 0.0003 Å
• c: 18.8906 ± 0.0003 Å
• α: 93.324 ± 0.001°
• β: 113.445 ± 0.001°
• γ: 99.843 ± 0.001°
• Cell volume: 4719.34 ± 0.15 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 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: 0.0887
• Residual factor for significantly intense reflections: 0.0647
• Weighted residual factors for significantly intense reflections: 0.1565
• Weighted residual factors for all reflections included in the refinement: 0.1799
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No