Information card for entry 8105830

Structure parameters

• Formula: C16 H20 N2 O6 Re2 S4
• Calculated formula: C16 H20 N2 O6 Re2 S4
• Title of publication: Redetermination of the crystal structure of bis(μ2-di-ethyldithiocarbamato-κ3 S,S′:S;κ3 S:S: S′)-hexacarbonyl-di-rhenium(I), C16H20N2O6Re2S4
• Authors of publication: Lee, See Mun; Lo, Kong Mun; Heard, Peter J.; Tiekink, Edward R.T.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2019
• Journal volume: 234
• Journal issue: 4
• Pages of publication: 719 - 721
• a: 15.349 ± 0.0002 Å
• b: 11.7992 ± 0.0001 Å
• c: 13.3377 ± 0.0001 Å
• α: 90°
• β: 103.998 ± 0.001°
• γ: 90°
• Cell volume: 2343.81 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0169
• Residual factor for significantly intense reflections: 0.0166
• Weighted residual factors for significantly intense reflections: 0.0443
• Weighted residual factors for all reflections included in the refinement: 0.0445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No