Information card for entry 7044263

Structure parameters

• Formula: C30 H50 Cl4 Dy2 O10
• Calculated formula: C30 H50 Cl4 Dy2 O10
• SMILES: c12O[Dy]([O]3CCCC3)([O]3CCCC3)(Cl)(Oc1cc1c(c2)O[Dy](O1)([O]1CCCC1)([O]1CCCC1)([O]1CCCC1)(Cl)Cl)([O]1CCCC1)Cl
• Title of publication: Thermal expansion and magnetic properties of benzoquinone-bridged dinuclear rare-earth complexes
• Authors of publication: Moilanen, Jani; Mansikkamäki, Akseli; Lahtinen, Manu; Guo, Fu-Sheng; Kalenius, Elina; Layfield, Richard; Chibotaru, Liviu F.
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 9.0173 ± 0.0005 Å
• b: 14.9995 ± 0.0009 Å
• c: 14.8171 ± 0.0008 Å
• α: 90°
• β: 106.402 ± 0.006°
• γ: 90°
• Cell volume: 1922.5 ± 0.2 ų
• Cell temperature: 120.01 ± 0.1 K
• Ambient diffraction temperature: 120.01 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0584
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1496
• Weighted residual factors for all reflections included in the refinement: 0.1524
• Goodness-of-fit parameter for all reflections included in the refinement: 1.179
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No