Information card for entry 7120966

Structure parameters

• Formula: C107 H95 Cl25 N4 O2 Pd2
• Calculated formula: C107 H95 Cl25 N4 O2 Pd2
• Title of publication: Alternating ring-opening metathesis polymerization by Grubbs-type catalysts with N-pentiptycenyl, N-alkyl-NHC ligands.
• Authors of publication: Vasiuta, Roman; Stockert, Alexander; Plenio, Herbert
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 14
• Pages of publication: 1706 - 1709
• a: 20.571 ± 0.001 Å
• b: 23.494 ± 0.001 Å
• c: 24.097 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11646 ± 0.9 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.1011
• Residual factor for significantly intense reflections: 0.0448
• Weighted residual factors for significantly intense reflections: 0.102
• Weighted residual factors for all reflections included in the refinement: 0.119
• Goodness-of-fit parameter for all reflections included in the refinement: 0.981
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No