Information card for entry 7023155

Structure parameters

• Formula: C72 H71.5 Gd N4.5 Ni O10.5
• Calculated formula: C72 H67.5 Gd N4.5 Ni O10.5
• Title of publication: Synthesis, crystal structure and magnetic properties of dinuclear NiIILnIII complexes based on a flexible polydentate ligand.
• Authors of publication: Xie, Qi-Wei; Wu, Shu-Qi; Liu, Cai-Ming; Cui, Ai-Li; Kou, Hui-Zhong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 31
• Pages of publication: 11227 - 11233
• a: 13.3208 ± 0.0005 Å
• b: 15.4148 ± 0.0006 Å
• c: 17.9987 ± 0.0007 Å
• α: 88.695 ± 0.0012°
• β: 73.26 ± 0.0012°
• γ: 70.245 ± 0.0012°
• Cell volume: 3319.5 ± 0.2 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.0557
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1409
• Weighted residual factors for all reflections included in the refinement: 0.1474
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No