Information card for entry 7118471

Structure parameters

• Formula: C39 H36 F9 N O9 P3 S3 Sb
• Calculated formula: C39 H36 F9 N O9 P3 S3 Sb
• SMILES: [Sb]12([P](CC[P]1(CC[P]2(c1ccccc1)c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)OS(=O)(=O)C(F)(F)F.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.N#CC
• Title of publication: Distinction between coordination and phosphine ligand oxidation: interactions of di- and triphosphines with Pn^3+^ (Pn = P, As, Sb, Bi)
• Authors of publication: Chitnis, Saurabh S.; Vos, Kevin A.; Burford, Neil; McDonald, Robert; Ferguson, Michael J.
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2016
• Journal volume: 52
• Pages of publication: 685 - 688
• a: 12.2821 ± 0.0002 Å
• b: 16.7365 ± 0.0003 Å
• c: 44.4675 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9140.7 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0438
• Residual factor for significantly intense reflections: 0.0415
• Weighted residual factors for significantly intense reflections: 0.0942
• Weighted residual factors for all reflections included in the refinement: 0.0956
• Goodness-of-fit parameter for all reflections included in the refinement: 1.191
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Duplicate of: 7118191
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No