Information card for entry 2231247

Structure parameters

• Chemical name: Poly[tetradecaaquatetrakis(μ~3~-imidazole-4,5-dicarboxylato)hexa-μ~3~- sulfato-cobalt(II)hexasamarium(III)]
• Formula: C20 H36 Co N8 O54 S6 Sm6
• Calculated formula: C20 H36 Co N8 O54 S6 Sm6
• Title of publication: Poly[tetradecaaquatetrakis(μ~3~-imidazole-4,5-dicarboxylato)hexa-μ~3~-sulfato-cobalt(II)hexasamarium(III)]
• Authors of publication: Zhu, Li-Cai; Zhu, Si-Ming
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: m1166 - m1167
• a: 6.6395 ± 0.001 Å
• b: 9.509 ± 0.0014 Å
• c: 21.619 ± 0.003 Å
• α: 97.068 ± 0.002°
• β: 94.391 ± 0.002°
• γ: 98.006 ± 0.002°
• Cell volume: 1335.2 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0403
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0652
• Weighted residual factors for all reflections included in the refinement: 0.0697
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes