Information card for entry 7026858

Structure parameters

• Common name: 8-(dimesitylboryl)quinoline-PdCl
• Chemical name: 8-(dimesitylboryl)quinoline-PdCl
• Formula: C27.75 H27 B Cl N Pd
• Calculated formula: C27.75 H27 B Cl N Pd
• SMILES: B1([c]23[c]4(cc(cc3C)C)C[Pd]24([n]2cccc3c2c1ccc3)Cl)c1c(cc(cc1C)C)C.CC#N
• Title of publication: Reactivity of the bifunctional ambiphilic molecule 8-(dimesitylboryl)quinoline: hydrolysis and coordination to Cu(I), Ag(I) and Pd(II).
• Authors of publication: Son, Jung-Ho; Pudenz, Michael A.; Hoefelmeyer, James D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 45
• Pages of publication: 11081 - 11090
• a: 19.6288 ± 0.0017 Å
• b: 7.8832 ± 0.0007 Å
• c: 31.428 ± 0.003 Å
• α: 90°
• β: 95.059 ± 0.001°
• γ: 90°
• Cell volume: 4844.2 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0569
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.0937
• Weighted residual factors for all reflections included in the refinement: 0.0985
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No