Information card for entry 7024296

Structure parameters

• Formula: C18 H17 F N2 Pd
• Calculated formula: C18 H17 F N2 Pd
• SMILES: [Pd]1(c2c(c3[n]1cccc3)cccc2)(F)[n]1c(cccc1C)C
• Title of publication: Synthesis and reactivity of palladium(II) fluoride complexes containing nitrogen-donor ligands.
• Authors of publication: Ball, Nicholas D.; Kampf, Jeff W.; Sanford, Melanie S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 2
• Pages of publication: 632 - 640
• a: 9.6607 ± 0.0011 Å
• b: 9.2742 ± 0.001 Å
• c: 17.81 ± 0.002 Å
• α: 90°
• β: 96.023 ± 0.002°
• γ: 90°
• Cell volume: 1586.9 ± 0.3 ų
• Cell temperature: 85 ± 2 K
• Ambient diffraction temperature: 85 ± 2 K
• Number of distinct elements: 5
• 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: 0.0383
• Residual factor for significantly intense reflections: 0.0323
• Weighted residual factors for significantly intense reflections: 0.0797
• Weighted residual factors for all reflections included in the refinement: 0.0842
• Goodness-of-fit parameter for all reflections included in the refinement: 1.142
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No