Information card for entry 4065412

Structure parameters

• Formula: C33 H35 Cl F3 N5 O2 Pd S
• Calculated formula: C33 H35 Cl F3 N5 O2 Pd S
• Title of publication: Facial Tridentate Ligands for Stabilizing Palladium(IV) Complexes
• Authors of publication: Maleckis, Ansis; Sanford, Melanie S.
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 24
• Pages of publication: 6617
• a: 9.9337 ± 0.0002 Å
• b: 13.4448 ± 0.0003 Å
• c: 14.1447 ± 0.001 Å
• α: 67.07 ± 0.005°
• β: 78.111 ± 0.005°
• γ: 73.844 ± 0.005°
• Cell volume: 1660.93 ± 0.15 ų
• Cell temperature: 85 ± 2 K
• Ambient diffraction temperature: 85 ± 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: 0.0273
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.0694
• Weighted residual factors for all reflections included in the refinement: 0.0696
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No