Information card for entry 7011670

Structure parameters

• Formula: C9 H18 Eu2 O18
• Calculated formula: C9 H18 Eu2 O18
• Title of publication: A phase transition in the novel three-dimensional compound [Eu2(mal)3(H2O)6] (H2mal = malonic acid)
• Authors of publication: María Hernández-Molina; Pablo Lorenzo-Luis; Catalina Ruiz-Pérez; Trinidad López; Inocencio R. Martín; Kirsty M. Anderson; A. Guy Orpen; Eduardo H. Bocanegra; Francesc Lloret; Miguel Julve
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 18
• Pages of publication: 3462 - 3470
• a: 11.0504 ± 0.0012 Å
• b: 12.2959 ± 0.0016 Å
• c: 13.467 ± 0.003 Å
• α: 90°
• β: 91.915 ± 0.016°
• γ: 90°
• Cell volume: 1828.8 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 9
• Hermann-Mauguin space group symbol: I 1 a 1
• Hall space group symbol: I -2ya
• Residual factor for all reflections: 0.0204
• Residual factor for significantly intense reflections: 0.019
• Weighted residual factors for significantly intense reflections: 0.0411
• Weighted residual factors for all reflections included in the refinement: 0.0414
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No