Information card for entry 7713649

Structure parameters

• Formula: C42 H56 N O4 Sb
• Calculated formula: C42 H56 N O4 Sb
• SMILES: [Sb](=O)(c1c(cccc1C(C)C)C(C)C)(c1c(C(C)C)cccc1C(C)C)c1c(cccc1C(C)C)C(C)C.Oc1ccc(N(=O)=O)cc1
• 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: 9.8747 ± 0.0002 Å
• b: 12.6935 ± 0.0003 Å
• c: 15.4719 ± 0.0003 Å
• α: 87.478 ± 0.002°
• β: 77.76 ± 0.002°
• γ: 83.096 ± 0.002°
• Cell volume: 1881.15 ± 0.07 ų
• Cell temperature: 99.95 ± 0.17 K
• Ambient diffraction temperature: 99.95 ± 0.17 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0341
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for significantly intense reflections: 0.0488
• Weighted residual factors for all reflections included in the refinement: 0.0535
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9511
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No