Information card for entry 4103848

Structure parameters

• Formula: C18 H26 F2 N2 Pd
• Calculated formula: C18 H26 F2 N2 Pd
• SMILES: [Pd]([n]1ccc(cc1)C(C)(C)C)(F)(F)[n]1ccc(cc1)C(C)(C)C
• Title of publication: trans-Difluoro Complexes of Palladium(II)
• Authors of publication: Vladimir V. Grushin; William J. Marshall
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 918 - 919
• a: 13.777 ± 0.003 Å
• b: 8.0323 ± 0.0017 Å
• c: 16.268 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1800.2 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.1114
• Residual factor for significantly intense reflections: 0.108
• Weighted residual factors for significantly intense reflections: 0.0599
• Weighted residual factors for all reflections included in the refinement: 0.0622
• Goodness-of-fit parameter for all reflections included in the refinement: 0.868
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No