Information card for entry 7047063

Structure parameters

• Common name: work
• Formula: C61 H53 B Cl2 F24 N5 O P Pd
• Calculated formula: C61 H53 B Cl2 F24 N5 O P Pd
• Title of publication: Phenylacetylene polymerisation mediated by cationic cyclometallated palladium(ii) complexes bearing benzylidene 2,6-diisopropylphenylamine and its derivatives as ligands.
• Authors of publication: Joseph, M. Cassiem; Swarts, Andrew J.; Mapolie, Selwyn F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 35
• Pages of publication: 12209 - 12217
• a: 13.9241 ± 0.0013 Å
• b: 18.1629 ± 0.0017 Å
• c: 25.815 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6528.7 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Ambient diffracton pressure: 101.3 kPa
• Number of distinct elements: 9
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0481
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1054
• Weighted residual factors for all reflections included in the refinement: 0.1084
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No