Information card for entry 2208278

Structure parameters

• Chemical name: poly[[tris(μ~2~-4,4'-bipyridine N,N'-dioxide)bis[trinitratothallium(III)]] dichloromethane disolvate]
• Formula: C32 H28 Cl4 N12 O24 Tl2
• Calculated formula: C32 H28 Cl4 N12 O24 Tl2
• Title of publication: A coordination polymer of thallium(III) nitrate with 4,4'-bipyridine <i>N</i>,<i>N</i>'-dioxide
• Authors of publication: Moitsheki, Lesego J.; Bourne, Susan A.; Nassimbeni, Luigi R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 3
• Pages of publication: m542 - m544
• a: 8.0425 ± 0.0016 Å
• b: 11.687 ± 0.002 Å
• c: 13.079 ± 0.003 Å
• α: 86.51 ± 0.03°
• β: 79.83 ± 0.03°
• γ: 78.75 ± 0.03°
• Cell volume: 1186.3 ± 0.4 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 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: 0.0422
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.1029
• Weighted residual factors for all reflections included in the refinement: 0.1071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes