Information card for entry 8105955

Structure parameters

• Formula: C20 H28 N2 O6 Re2 S4
• Calculated formula: C20 H28 N2 O6 Re2 S4
• Title of publication: Crystal structure of hexacarbonyl-bis(μ2-di-n-propyldithiocarbamato-κ3 S,S′:S;κ3 S:S:S′)-di-rhenium(I), C20H28N2O6Re2S4
• Authors of publication: Lo, Kong Mun; Lee, See 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: 5
• Pages of publication: 1125 - 1127
• a: 17.9296 ± 0.0004 Å
• b: 9.6012 ± 0.0001 Å
• c: 16.1859 ± 0.0003 Å
• α: 90°
• β: 103.934 ± 0.002°
• γ: 90°
• Cell volume: 2704.34 ± 0.09 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: 0.0337
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.0901
• Weighted residual factors for all reflections included in the refinement: 0.0902
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No