Information card for entry 7109839

Structure parameters

• Formula: C112 H136 Cl2 Cu2 Gd0 Mo2 N32 Ni2 O44 Tb2
• Calculated formula: C112 H96 Cl2 Cu2 Mo2 N32 Ni2 O44 Tb2
• Title of publication: A new versatile class of hetero-tetra-metallic assemblies: highlighting single-molecule magnet behaviour
• Authors of publication: Nathalie Bridonneau; Lise-Marie Chamoreau; Philippe P. Laine; Wolfgang Wernsdorfer; Valerie Marvaud
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 9476
• a: 23.0051 ± 0.0004 Å
• b: 29.8285 ± 0.0006 Å
• c: 42.2334 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 28980.9 ± 0.9 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 10
• Space group number: 70
• Hermann-Mauguin space group symbol: F d d d :2
• Hall space group symbol: -F 2uv 2vw
• Residual factor for all reflections: 0.0607
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.121
• Weighted residual factors for all reflections included in the refinement: 0.1396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No