Information card for entry 7107269

Structure parameters

• Formula: C20 H20 Cl2 Dy2
• Calculated formula: C20 H20 Cl2 Dy2
• SMILES: [cH]12[cH]3[cH]4[cH]5[cH]1[Dy]167892345([cH]2[cH]1[cH]6[cH]7[cH]82)[Cl][Dy]12345678([cH]%10[cH]1[cH]2[cH]3[cH]4%10)([cH]1[cH]8[cH]7[cH]6[cH]51)[Cl]9
• Title of publication: Single-molecule magnetism in cyclopentadienyl-dysprosium chlorides
• Authors of publication: Scott A. Sulway; Richard A. Layfield; Floriana Tuna; Wolfgang Wernsdorfer; Richard E. P. Winpenny
• Journal of publication: Chem. Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 1508
• a: 10.8935 ± 0.0006 Å
• b: 7.7893 ± 0.0003 Å
• c: 12.409 ± 0.0007 Å
• α: 90°
• β: 111.968 ± 0.006°
• γ: 90°
• Cell volume: 976.49 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0469
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.0771
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections included in the refinement: 0.962
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No