Information card for entry 4301962

Structure parameters

• Formula: C16 H37 Cl F6 N P3 Pd
• Calculated formula: C16 H37 Cl F6 N P3 Pd
• SMILES: [Pd]12(Cl)[P](CC[NH]2CC[P]1(C(C)C)C(C)C)(C(C)C)C(C)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Palladium N(CH2CH2PiPr2)2-Dialkylamides: Synthesis, Structural Characterization, and Reactivity
• Authors of publication: Alexander N. Marziale; Eberhardt Herdtweck; Jörg Eppinger; Sven Schneider
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 3699 - 3709
• a: 8.6831 ± 0.0001 Å
• b: 15.4168 ± 0.0002 Å
• c: 18.435 ± 0.0002 Å
• α: 90°
• β: 95.21 ± 0.001°
• γ: 90°
• Cell volume: 2457.62 ± 0.05 ų
• Cell temperature: 153 ± 1 K
• Ambient diffraction temperature: 153 ± 1 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 all reflections: 0.0327
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.0669
• Goodness-of-fit parameter for all reflections included in the refinement: 1.153
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No