Information card for entry 2243856

Structure parameters

• Chemical name: Poly[di-μ-bromido-bis(μ-tetrahydrothiophene)dicopper(I)]
• Formula: C8 H16 Br2 Cu2 S2
• Calculated formula: C8 H16 Br2 Cu2 S2
• Title of publication: Crystal structure of the two-dimensional coordination polymer poly[di-μ-bromido-bis(μ-tetrahydrothiophene)dicopper(I)]
• Authors of publication: Knorr, Michael; Viau, Lydie; Rousselin, Yoann; Kubicki, Marek M.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2021
• Journal volume: 77
• Journal issue: 7
• Pages of publication: 744 - 748
• a: 6.8076 ± 0.0003 Å
• b: 9.7078 ± 0.0004 Å
• c: 10.1579 ± 0.0004 Å
• α: 75.804 ± 0.002°
• β: 89.845 ± 0.002°
• γ: 89.594 ± 0.002°
• Cell volume: 650.79 ± 0.05 ų
• Cell temperature: 115 ± 0.1 K
• Ambient diffraction temperature: 115 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0333
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0729
• Weighted residual factors for all reflections included in the refinement: 0.0754
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα~1~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes