Information card for entry 4309109

Structure parameters

• Formula: C21 H22 Eu F9 N4 O11 S3
• Calculated formula: C21 H22 Eu F9 N4 O11 S3
• SMILES: [Eu]123([OH2])([OH2])([n]4c(C[N]3(Cc3[n]1cccc3)Cc1[n]2cccc1)cccc4)(OS(=O)(=O)C(F)(F)F)(OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F
• Title of publication: Controlled Hydrolysis of Lanthanide Complexes of the N-Donor Tripod Tris(2-pyridylmethyl)amine versus Bisligand Complex Formation
• Authors of publication: Louise Natrajan; Jacques Pécaut; Marinella Mazzanti; Colette LeBrun
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 4756 - 4765
• a: 10.4864 ± 0.0014 Å
• b: 11.584 ± 0.0016 Å
• c: 13.948 ± 0.002 Å
• α: 74.694 ± 0.003°
• β: 88.535 ± 0.002°
• γ: 76.139 ± 0.002°
• Cell volume: 1585.4 ± 0.4 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.023
• Residual factor for significantly intense reflections: 0.021
• Weighted residual factors for significantly intense reflections: 0.0501
• Weighted residual factors for all reflections included in the refinement: 0.052
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No