Information card for entry 4305386

Structure parameters

• Chemical name: tricarbonyltris(tetrahydrothiophene)rhenium(I) hexafluorophosphate
• Formula: C15 H24 F6 O3 P Re S3
• Calculated formula: C15 F6 O3 P Re S3
• Title of publication: Reactions of the Re(CO)3(H2O)3+ Synthon with Monodentate Ligands under Aqueous Conditions
• Authors of publication: Brenton R. Franklin; Richard S. Herrick; Christopher J. Ziegler; Natalie Barone; Laura R. Condon
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 5902 - 5909
• a: 11.1729 ± 0.0019 Å
• b: 11.1729 ± 0.0019 Å
• c: 14.705 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1589.7 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 160
• Hermann-Mauguin space group symbol: R 3 m :H
• Hall space group symbol: R 3 -2"
• Residual factor for all reflections: 0.0169
• Residual factor for significantly intense reflections: 0.0169
• Weighted residual factors for significantly intense reflections: 0.0397
• Weighted residual factors for all reflections included in the refinement: 0.0397
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No