Information card for entry 1566709

Structure parameters

• Formula: C28 H28 Cl O P2 Rh S
• Calculated formula: C28 H28 Cl O P2 Rh S
• Title of publication: Sulfonium cations as versatile strongly π-acidic ligands
• Authors of publication: Li, Ruiping; Barel, Nitsan; Subramaniyan, Vasudevan; Cohen, Orit; Tibika, Françoise; Tulchinsky, Yuri
• Journal of publication: Chemical Science
• Year of publication: 2022
• a: 10.4581 ± 0.0002 Å
• b: 14.2792 ± 0.0003 Å
• c: 17.4031 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2598.86 ± 0.09 ų
• Cell temperature: 149.9 ± 0.2 K
• Ambient diffraction temperature: 150.15 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0207
• Residual factor for significantly intense reflections: 0.0191
• Weighted residual factors for significantly intense reflections: 0.0449
• Weighted residual factors for all reflections included in the refinement: 0.0455
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No