Information card for entry 2229878

Structure parameters

• Chemical name: Poly[[dodecaaquahexakis(μ~2~-pyridine-2,5- dicarboxylato)tricopper(II)diytterbium(III)] dihydrate]
• Formula: C42 H50 Cu3 N6 O40 Yb2
• Calculated formula: C42 H50 Cu3 N6 O40 Yb2
• Title of publication: Poly[[dodecaaquahexakis(μ~2~-pyridine-2,5-dicarboxylato)tricopper(II)diytterbium(III)] dihydrate]
• Authors of publication: Shen, Fwu Ming; Lush, Shie Fu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 4
• Pages of publication: m406 - m407
• a: 7.3486 ± 0.0004 Å
• b: 13.5417 ± 0.0007 Å
• c: 15.1244 ± 0.0008 Å
• α: 72.534 ± 0.001°
• β: 76.33 ± 0.001°
• γ: 80.166 ± 0.001°
• Cell volume: 1386.89 ± 0.13 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0592
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.0809
• Weighted residual factors for all reflections included in the refinement: 0.0833
• Goodness-of-fit parameter for all reflections included in the refinement: 1.227
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes