Information card for entry 2221198

Structure parameters

• Chemical name: Poly[[tris[μ-2,2'-(butane-1,4-diyldithio)bis(1,3,4-thiadiazole)- κ^2^<i>N</i>^4^:<i>N</i>^4'^]copper(II)] bis(perchlorate)]
• Formula: C24 H30 Cl2 Cu N12 O8 S12
• Calculated formula: C24 H30 Cl2 Cu N12 O8 S12
• Title of publication: Poly[[tris[μ-2,2'-(butane-1,4-diyldithio)bis(1,3,4-thiadiazole)-κ^2^<i>N</i>^4^:<i>N</i>^4'^]copper(II)] bis(perchlorate)]
• Authors of publication: Hu, Pu-Zhou; Qin, Jian-Hua; Wang, Jian-Ge
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 3
• Pages of publication: m307
• a: 10.5455 ± 0.0006 Å
• b: 10.5455 ± 0.0006 Å
• c: 33.728 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3248.3 ± 0.5 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 7
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.061
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.1216
• Weighted residual factors for all reflections included in the refinement: 0.1331
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes