Information card for entry 7053206

Structure parameters

• Formula: C46 H60 Dy2 N4 O14
• Calculated formula: C46 H60 Dy2 N4 O14
• SMILES: C1(=CC(=[O][Dy]234(O1)([O]=C(C)C=C(O2)C)ON1C(=N(=O)C(C)(C)C1(C)C)c1c([O]3[Dy]235(OC(=CC(C)=[O]2)C)([O]=C(C)C=C(O3)C)[O]4c2ccccc2C2N(O5)C(C(N=2=O)(C)C)(C)C)cccc1)C)C
• Title of publication: Dinuclear lanthanide complexes bridged by nitronyl nitroxide radical ligands with 2-phenolate groups: structure and magnetic properties
• Authors of publication: Mei, Xuelan; Wang, Xiufeng; Wang, Juanjuan; Ma, Yue; Li, Licun; Liao, Daizheng
• Journal of publication: New Journal of Chemistry
• Year of publication: 2013
• Journal volume: 37
• Journal issue: 11
• Pages of publication: 3620
• a: 10.453 ± 0.005 Å
• b: 11.248 ± 0.005 Å
• c: 11.848 ± 0.005 Å
• α: 104.288 ± 0.007°
• β: 98.792 ± 0.004°
• γ: 114.28 ± 0.004°
• Cell volume: 1178.4 ± 0.9 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0422
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0638
• Weighted residual factors for all reflections included in the refinement: 0.0657
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No