Information card for entry 7006738

Structure parameters

• Formula: C39 H48 F6 N2 O2 P Pd S Sb
• Calculated formula: C39 H48 F6 N2 O2 P Pd S Sb
• Title of publication: Structure and reactivity of new phosphine ligands containing the hemi-labile sulfone moiety.
• Authors of publication: Chapman, Christopher J.; Frost, Christopher G.; Mahon, Mary F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 18
• Pages of publication: 2251 - 2262
• a: 18.492 ± 0.0002 Å
• b: 12.263 ± 0.001 Å
• c: 18.586 ± 0.0002 Å
• α: 90°
• β: 102.396 ± 0.001°
• γ: 90°
• Cell volume: 4116.4 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 9
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0305
• Residual factor for significantly intense reflections: 0.0244
• Weighted residual factors for significantly intense reflections: 0.0609
• Weighted residual factors for all reflections included in the refinement: 0.0646
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No