Information card for entry 4087619

Structure parameters

• Formula: C33 H42 P2 Pd
• Calculated formula: C33 H42 P2 Pd
• Title of publication: C‒H Activation Reactions of a Nucleophilic Palladium Carbene
• Authors of publication: Comanescu, Cezar C.; Iluc, Vlad M.
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 19
• Pages of publication: 4684
• a: 20.2923 ± 0.0019 Å
• b: 8.504 ± 0.0008 Å
• c: 17.8967 ± 0.0017 Å
• α: 90°
• β: 103.729 ± 0.0013°
• γ: 90°
• Cell volume: 3000.1 ± 0.5 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• 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: 0.0495
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.1288
• Weighted residual factors for all reflections included in the refinement: 0.1317
• 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: Yes
• Has Fobs: No