Information card for entry 7713640

Structure parameters

• Formula: C37 H52 F3 O4 S Sb
• Calculated formula: C37 H52 F3 O4 S Sb
• SMILES: [Sb](O)(c1c(C(C)C)cccc1C(C)C)(c1c(cccc1C(C)C)C(C)C)c1c(C(C)C)cccc1C(C)C.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Variation in pnictogen-oxygen bonding unlocks greatly enhanced Brønsted basicity for the monomeric stibine oxide.
• Authors of publication: Wenger, John S.; Getahun, Addis; Johnstone, Timothy C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2023
• a: 10.1952 ± 0.0001 Å
• b: 12.5826 ± 0.0001 Å
• c: 14.9502 ± 0.0001 Å
• α: 90.256 ± 0.001°
• β: 98.443 ± 0.001°
• γ: 105.17 ± 0.001°
• Cell volume: 1829.1 ± 0.03 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0209
• Residual factor for significantly intense reflections: 0.0198
• Weighted residual factors for significantly intense reflections: 0.0489
• Weighted residual factors for all reflections included in the refinement: 0.0494
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No