Information card for entry 7105676

Structure parameters

• Formula: C21 H38 O P2 Pd
• Calculated formula: C21 H38 O P2 Pd
• Title of publication: Selective Reduction of a Pd Pincer PCP Complex to Well-Defined Pd(0) Species
• Authors of publication: Crisobal Melero; Luis Martinez-Prieto; Pilar Palma; Diego del Rio; Eleuterio Alvarez; Juan Campora
• Journal of publication: Chem.Commun.
• Year of publication: 2010
• Journal volume: 46
• Pages of publication: 8851
• a: 11.3085 ± 0.0008 Å
• b: 14.3116 ± 0.001 Å
• c: 28.797 ± 0.002 Å
• α: 90°
• β: 98.271 ± 0.002°
• γ: 90°
• Cell volume: 4612.1 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.1086
• Residual factor for significantly intense reflections: 0.0745
• Weighted residual factors for significantly intense reflections: 0.1548
• Weighted residual factors for all reflections included in the refinement: 0.1741
• Goodness-of-fit parameter for all reflections included in the refinement: 1.187
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No