Information card for entry 1518478

Structure parameters

• Formula: C22 H35 F6 O6 Pd Sb
• Calculated formula: C22 H35 F6 O6 Pd Sb
• SMILES: [Sb](F)(F)(F)([F-])(F)F.[Pd]12([O]3CCCC3)([O]3CCCC3)[CH2]=[CH]1C[C@@H]1[C@H]3[C@H]([C@H]([C@@H]([C@H]21)C3)C(=O)OC)C(=O)OC.[Sb](F)(F)(F)([F-])(F)F.[Pd]12([O]3CCCC3)([O]3CCCC3)[CH2]=[CH]1C[C@H]1[C@@H]3[C@@H]([C@@H]([C@H]([C@@H]21)C3)C(=O)OC)C(=O)OC
• Title of publication: Bypassing the lack of reactivity of endo-substituted norbornenes with the catalytic rectification‒insertion mechanism
• Authors of publication: Commarieu, Basile; Claverie, Jerome P.
• Journal of publication: Chem. Sci.
• Year of publication: 2015
• Journal volume: 6
• Journal issue: 4
• Pages of publication: 2172
• a: 16.758 ± 0.003 Å
• b: 16.947 ± 0.004 Å
• c: 9.5046 ± 0.0019 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2699.3 ± 1 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0404
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.062
• Weighted residual factors for all reflections included in the refinement: 0.067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No