Information card for entry 2013524

Structure parameters

• Common name: erbium mellitate
• Chemical name: catena-Poly[[bis[pentaaquaerbium(III)]-μ-benzenehexacarboxylato] tetrahydrate]
• Formula: C12 H28 Er2 O26
• Calculated formula: C12 Er2 O26
• Title of publication: <i>catena</i>-Poly[[bis[pentaaquaerbium(III)]-μ-benzenehexacarboxylato] tetrahydrate]
• Authors of publication: Deluzet, André; Guillou, Olivier
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 7
• Pages of publication: m277 - m279
• a: 8.4499 ± 0.0001 Å
• b: 9.2595 ± 0.0002 Å
• c: 16.2911 ± 0.0004 Å
• α: 90°
• β: 100.339 ± 0.0008°
• γ: 90°
• Cell volume: 1253.95 ± 0.04 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• 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: 0.053
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.085
• Weighted residual factors for all reflections included in the refinement: 0.093
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes