Information card for entry 2204752

Structure parameters

• Chemical name: Bis(tetra-n-butylammonium) tetrakis[chloro(μ~3~-sulfido)copper(I)]tungstate(VI)
• Formula: C32 H72 Cl4 Cu4 N2 S4 W
• Calculated formula: C32 H72 Cl4 Cu4 N2 S4 W
• Title of publication: Bis(tetra-<i>n</i>-butylammonium) tetrakis[chloro(μ~3~-sulfido)copper(I)]tungstate(VI): a second polymorph
• Authors of publication: Hossaini Sadr, Moayad; Seyed Ahmadian, Seyed Masoud; Brooks, Neil R.; Clegg, William
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 12
• Pages of publication: m1952 - m1954
• a: 13.3652 ± 0.0005 Å
• b: 13.3652 ± 0.0005 Å
• c: 13.668 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2441.5 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 85
• Hermann-Mauguin space group symbol: P 4/n :2
• Hall space group symbol: -P 4a
• Residual factor for all reflections: 0.0304
• Residual factor for significantly intense reflections: 0.0216
• Weighted residual factors for significantly intense reflections: 0.0501
• Weighted residual factors for all reflections included in the refinement: 0.0558
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes