Information card for entry 4072813

Structure parameters

• Chemical name: 1,1'-Bis(N-(2,4,6-triisopropyl)-amino)-ferrocen)
• Formula: C40 H56 Fe N2
• Calculated formula: C40 H56 Fe N2
• Title of publication: Zirconium Chelates of a Bulky Ferrocene-Based Diamido Ligand
• Authors of publication: Siemeling, Ulrich; Auch, Tanja-Corinna; Tomm, Sabine; Fink, Heinrich; Bruhn, Clemens; Neumann, Beate; Stammler, Hans-Georg
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 4
• Pages of publication: 1112
• a: 10.7844 ± 0.0006 Å
• b: 15.6589 ± 0.0009 Å
• c: 15.9946 ± 0.0008 Å
• α: 90.26 ± 0.004°
• β: 100.2 ± 0.004°
• γ: 98.973 ± 0.004°
• Cell volume: 2624.4 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1023
• Residual factor for significantly intense reflections: 0.0779
• Weighted residual factors for significantly intense reflections: 0.1668
• Weighted residual factors for all reflections included in the refinement: 0.1724
• Goodness-of-fit parameter for all reflections included in the refinement: 1.188
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No