Information card for entry 7024299

Structure parameters

• Formula: C13 H21 Cl2 F N2 Pd
• Calculated formula: C13 H21 Cl2 F N2 Pd
• SMILES: [Pd]12(F)[N](Cc3cccc(c23)C[N]1(C)C)(C)C.ClCCl
• 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: 8.4407 ± 0.0006 Å
• b: 9.5451 ± 0.0006 Å
• c: 11.5693 ± 0.0008 Å
• α: 105.314 ± 0.001°
• β: 95.629 ± 0.001°
• γ: 116.01 ± 0.001°
• Cell volume: 782.97 ± 0.09 ų
• Cell temperature: 85 ± 2 K
• Ambient diffraction temperature: 85 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.015
• Residual factor for significantly intense reflections: 0.0147
• Weighted residual factors for significantly intense reflections: 0.0386
• Weighted residual factors for all reflections included in the refinement: 0.0387
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No