Information card for entry 2311956

Structure parameters

• Chemical name: Poly[tetra-<i>n</i>-butylammonium [bis(μ~2~-dimethyldithiocarbamato)dodeca-μ~3~-iodido-hexa-μ~2~-iodido-tetracopper(I)copper(II)hexalead(II)]]
• Formula: C38 H84 Cu5 I18 N4 Pb6 S4
• Calculated formula: C38 H84 Cu5 I18 N4 Pb6 S4
• Title of publication: Syntheses and crystal structures of two heterometallic iodoplumbates containing mixed-valence copper(I/II).
• Authors of publication: Fan, Le Qing; Zhu, Xiao Tong
• Journal of publication: Acta crystallographica. Section C, Structural chemistry
• Year of publication: 2017
• Journal volume: 73
• Journal issue: Pt 12
• Pages of publication: 1098 - 1103
• a: 13.5451 ± 0.0018 Å
• b: 13.889 ± 0.0019 Å
• c: 14.4514 ± 0.0012 Å
• α: 94.449 ± 0.003°
• β: 92.316 ± 0.003°
• γ: 119.009 ± 0.004°
• Cell volume: 2361 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0847
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for significantly intense reflections: 0.1138
• Weighted residual factors for all reflections included in the refinement: 0.1277
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No