Information card for entry 4338905

Structure parameters

• Formula: C48 H88 Br2.22 Cu5 Gd2 N7.78 O46.34
• Calculated formula: C48 H74 Br2.22 Cu5 Gd2 N7.78 O46.34
• Title of publication: Bifunctional ligand approach for constructing 3d-4f heterometallic clusters.
• Authors of publication: Wu, Gang; Hewitt, Ian J.; Mameri, Samir; Lan, Yanhua; Clérac, Rodolphe; Anson, Christopher E.; Qiu, Shilun; Powell, Annie K.
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 18
• Pages of publication: 7229 - 7231
• a: 11.6809 ± 0.001 Å
• b: 12.5918 ± 0.001 Å
• c: 15.1061 ± 0.0013 Å
• α: 104.569 ± 0.007°
• β: 99.987 ± 0.007°
• γ: 112.359 ± 0.006°
• Cell volume: 1896.7 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.061
• Residual factor for significantly intense reflections: 0.0535
• Weighted residual factors for significantly intense reflections: 0.1386
• Weighted residual factors for all reflections included in the refinement: 0.145
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No