Information card for entry 7125608

Structure parameters

• Formula: C115 H97 Cu F66 N8 O35 Tb3
• Calculated formula: C115 H95 Cu F66 N8 O34 Tb3
• Title of publication: Nitronyl nitroxide-metal complexes as metallo-ligands for the construction of hetero-tri-spin (2p-3d-4f) chains.
• Authors of publication: Zhu, Mei; Mei, Xuelan; Ma, Yue; Li, Licun; Liao, Daizheng; Sutter, Jean-Pascal
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2014
• Journal volume: 50
• Journal issue: 15
• Pages of publication: 1906 - 1908
• a: 19.973 ± 0.005 Å
• b: 19.983 ± 0.004 Å
• c: 21.679 ± 0.004 Å
• α: 90.959 ± 0.002°
• β: 107.219 ± 0.002°
• γ: 114.941 ± 0.004°
• Cell volume: 7393 ± 3 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.0732
• Residual factor for significantly intense reflections: 0.0607
• Weighted residual factors for significantly intense reflections: 0.1243
• Weighted residual factors for all reflections included in the refinement: 0.1318
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No