Information card for entry 2220222

Structure parameters

• Common name: Dibromidobis(<i>N</i>,<i>N</i>-diethyldithiocarbamato- κ^2^<i>S</i>,<i>S'</i>)tetra-μ~3~-sulfido-dicopper(I)dimolybdenum(V) isopropanol disolvate
• Formula: C20 H44 Br2 Cu2 Mo2 N2 O2 S8
• Calculated formula: C20 H44 Br2 Cu2 Mo2 N2 O2 S8
• Title of publication: Dibromidobis(<i>N</i>,<i>N</i>-diethyldithiocarbamato-κ^2^<i>S</i>,<i>S</i>')tetra-μ~3~-sulfido-dicopper(I)dimolybdenum(V) isopropanol disolvate
• Authors of publication: Zhang, Qing; Liu, Min
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: m1540
• a: 12.515 ± 0.003 Å
• b: 12.734 ± 0.003 Å
• c: 12.759 ± 0.003 Å
• α: 107.76 ± 0.03°
• β: 108.26 ± 0.03°
• γ: 90.12 ± 0.03°
• Cell volume: 1828.2 ± 0.9 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0646
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.115
• Weighted residual factors for all reflections included in the refinement: 0.1207
• Goodness-of-fit parameter for all reflections included in the refinement: 1.119
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes