Information card for entry 4106823

Structure parameters

• Formula: C49.5 H41 B2 F8 N4.5 O Pd2
• Calculated formula: C49.5 H35 B2 F8 N4.5 O Pd2
• Title of publication: Oxidative Dinuclear Addition of a PdI-PdI Moiety to Arenes: Generation of μ-η3:η3-Arene-PdII2 Species
• Authors of publication: Tetsuro Murahashi; Kohei Takase; Masa-aki Oka; Sensuke Ogoshi
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 14908 - 14911
• a: 17.4255 ± 0.0007 Å
• b: 23.6328 ± 0.001 Å
• c: 21.2105 ± 0.0009 Å
• α: 90°
• β: 98.0275 ± 0.0012°
• γ: 90°
• Cell volume: 8649.2 ± 0.6 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 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 significantly intense reflections: 0.0496
• Weighted residual factors for all reflections included in the refinement: 0.0571
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No