Information card for entry 4325446

Structure parameters

• Formula: C11 H14 I3 O3 Pd n
• Calculated formula: C11 H14 I3 N O3 Pd
• Title of publication: Synthesis, Isolation, and Characterization of an Organometallic Triiodopalladium(IV) Complex. Quantitative and Regioselective Synthesis of Two C-I Reductive Elimination Products
• Authors of publication: José Vicente; Aurelia Arcas; Francisco Juliá-Hernández; Delia Bautista
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 5339 - 5341
• a: 9.328 ± 0.004 Å
• b: 13.261 ± 0.005 Å
• c: 13.698 ± 0.005 Å
• α: 90°
• β: 100.154 ± 0.006°
• γ: 90°
• Cell volume: 1667.9 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0269
• Residual factor for significantly intense reflections: 0.0248
• Weighted residual factors for significantly intense reflections: 0.0548
• Weighted residual factors for all reflections included in the refinement: 0.0557
• Goodness-of-fit parameter for all reflections included in the refinement: 1.143
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No