Information card for entry 4077312

Structure parameters

• Formula: C25 H38 Cl N2 O4 P Pd
• Calculated formula: C25 H38 Cl N2 O4 P Pd
• Title of publication: Palladium Complexes with a New Hemilabile Bis(oxazoline)phenylphosphonite Ligand. Characterization of an Unprecedented Chloro Palladium(II)−(η1-Allyl) Complex‖
• Authors of publication: Braunstein, Pierre; Naud, Frédéric; Dedieu, Alain; Rohmer, Marie-Madeleine; DeCian, André; Rettig, Steven J.
• Journal of publication: Organometallics
• Year of publication: 2001
• Journal volume: 20
• Journal issue: 14
• Pages of publication: 2966
• a: 15.6689 ± 0.0005 Å
• b: 10.0997 ± 0.0004 Å
• c: 17.5458 ± 0.0003 Å
• α: 90°
• β: 100.359 ± 0.002°
• γ: 90°
• Cell volume: 2731.39 ± 0.15 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for all reflections: 0.059
• Weighted residual factors for all reflections included in the refinement: 0.057
• Goodness-of-fit parameter for all reflections: 1.167
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No