Information card for entry 4075944

Structure parameters

• Formula: C54 H68 Ag B F4 N4
• Calculated formula: C54 H68 Ag B F4 N4
• Title of publication: Synthesis and Structure of N-Heterocyclic Carbene Complexes with Tethered Olefinic Groups: Application of the Ruthenium Catalyst in Olefin Metathesis
• Authors of publication: Weigl, Kerstin; Köhler, Katrin; Dechert, Sebastian; Meyer, Franc
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 16
• Pages of publication: 4049
• a: 18.3537 ± 0.0006 Å
• b: 23.3319 ± 0.0008 Å
• c: 23.5876 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10100.8 ± 0.7 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 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: 0.0743
• Residual factor for significantly intense reflections: 0.0476
• Weighted residual factors for significantly intense reflections: 0.1347
• Weighted residual factors for all reflections included in the refinement: 0.1468
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No