Information card for entry 7703407

Structure parameters

• Formula: C27 H38 Ti
• Calculated formula: C27 H38 Ti
• Title of publication: Synthesis of a titanium ethylene complex via C-H-activation and alternative access to Cp₂Ti(η²-Me₃SiC₂SiMe₃).
• Authors of publication: Fischer, Malte; Vincent-Heldt, Lisa; Hillje, Malena; Schmidtmann, Marc; Beckhaus, Ruediger
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 7
• Pages of publication: 2068 - 2072
• a: 9.181 ± 0.0003 Å
• b: 11.4645 ± 0.0004 Å
• c: 20.7463 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2183.66 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0626
• Residual factor for significantly intense reflections: 0.0438
• Weighted residual factors for significantly intense reflections: 0.1112
• Weighted residual factors for all reflections included in the refinement: 0.1238
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No