Information card for entry 4088989

Structure parameters

• Formula: C37 H39 Cl2 F12 Fe3 N3 S Sb2
• Calculated formula: C37 H39 Cl2 F12 Fe3 N3 S Sb2
• Title of publication: Generation and Oligomerization ofN-Ferrocenyl Ketenimines via Open-Shell Intermediates
• Authors of publication: Kienz, Torben; Förster, Christoph; Heinze, Katja
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 21
• Pages of publication: 3681
• a: 9.6219 ± 0.0008 Å
• b: 13.1 ± 0.0011 Å
• c: 17.2736 ± 0.0015 Å
• α: 104.403 ± 0.002°
• β: 92.447 ± 0.002°
• γ: 96.711 ± 0.002°
• Cell volume: 2088.6 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1114
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1172
• Weighted residual factors for all reflections included in the refinement: 0.1329
• Goodness-of-fit parameter for all reflections included in the refinement: 0.883
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No