Information card for entry 7210509

Structure parameters

• Formula: C42 H118 Cl8 Dy4 N6 O66
• Calculated formula: C42 H82 Cl8 Dy4 N6 O66
• SMILES: [Dy]12345([OH2])([O]=C(C6(CCCCC6)[NH3+])O[Dy]6789([O]=C(C%10(CCCCC%10)[NH3+])O[Dy]%10%11([OH2])([OH2])([O]=C(C%12(CCCCC%12)[NH3+])O1)([O]=C(C1(CCCCC1)[NH3+])O[Dy]([OH2])([OH2])([O]=C(C1(CCCCC1)[NH3+])O2)([O]=C(C1(CCCCC1)[NH3+])O6)([OH]37)([OH]8%10)[OH]5%11)[OH]49)([OH2])[OH2])OCl(=O)(=O)=O.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].O.O.O.O.O.O.O.O.O.O.O
• Title of publication: A series of di-, tri- and tetranuclear lanthanide clusters with slow magnetic relaxation for Dy2 and Dy4
• Authors of publication: Peng, Jun-Bo; Ren, Yan-Ping; Kong, Xiang-Jian; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 6
• Pages of publication: 2084 - 2090
• a: 13.1386 ± 0.0002 Å
• b: 26.5893 ± 0.0006 Å
• c: 26.6992 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9327.3 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0574
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.0481
• Weighted residual factors for all reflections included in the refinement: 0.0503
• Goodness-of-fit parameter for all reflections included in the refinement: 0.825
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No