Information card for entry 7104224

Structure parameters

• Formula: C26 H36 Bi I O3 S
• Calculated formula: C26 H28 Bi I O3 S
• Title of publication: Synthesis and structure of bismuth compounds bearing a sulfur-bridged bis(phenolato) ligand and their catalytic application to the solvent-free synthesis of propylene carbonate from CO2 and propylene oxide.
• Authors of publication: Yin, Shuang-Feng; Shimada, Shigeru
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 9
• Pages of publication: 1136 - 1138
• a: 29.9918 ± 0.0018 Å
• b: 9.1349 ± 0.0005 Å
• c: 20.2035 ± 0.0012 Å
• α: 90°
• β: 95.083 ± 0.001°
• γ: 90°
• Cell volume: 5513.4 ± 0.6 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 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 significantly intense reflections: 0.035
• Weighted residual factors for all reflections included in the refinement: 0.0884
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No