Information card for entry 2216181

Structure parameters

• Chemical name: Poly[[diaquabis(μ~4~-benzene-1,3-dicarboxylato)(μ~3~-benzene-1,3- dicarboxylato)dierbium(III)] monohydrate]
• Formula: C24 H18 Er2 O15
• Calculated formula: C24 H18 Er2 O15
• Title of publication: Poly[[diaquabis(μ~4~-benzene-1,3-dicarboxylato)(μ~3~-benzene-1,3-dicarboxylato)dierbium(III)] monohydrate]
• Authors of publication: Wen-Dong Song; De-Yun Ma; Chao-Hua Zhang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2826 - m2827
• a: 10.5553 ± 0.0002 Å
• b: 14.9526 ± 0.0003 Å
• c: 17.4798 ± 0.0003 Å
• α: 90°
• β: 103.908 ± 0.001°
• γ: 90°
• Cell volume: 2677.94 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0221
• Residual factor for significantly intense reflections: 0.0188
• Weighted residual factors for significantly intense reflections: 0.0434
• Weighted residual factors for all reflections included in the refinement: 0.0445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes