Information card for entry 7006737

Structure parameters

• Formula: C41.25 H50 Cl3 N2 O2 P Pd S
• Calculated formula: C41.3 H50 Cl3 N2 O2 P Pd S
• 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: 10.62 ± 0.0001 Å
• b: 15.327 ± 0.0001 Å
• c: 15.398 ± 0.0001 Å
• α: 108.523 ± 0.001°
• β: 100.29 ± 0.001°
• γ: 108.962 ± 0.001°
• Cell volume: 2133.66 ± 0.04 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0381
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0837
• Weighted residual factors for all reflections included in the refinement: 0.0872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No