Information card for entry 4110596

Structure parameters

• Formula: C17 H23 N Si Ti0.5
• Calculated formula: C17 H23 N Si Ti0.5
• Title of publication: Mono(dinitrogen) and Carbon Monoxide Adducts of Bis(cyclopentadienyl) Titanium Sandwiches
• Authors of publication: Tamara E. Hanna; Emil Lobkovsky; Paul J. Chirik
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Pages of publication: 6018 - 6019
• a: 19.2468 ± 0.0006 Å
• b: 12.0669 ± 0.0004 Å
• c: 14.6246 ± 0.0005 Å
• α: 90°
• β: 110.937 ± 0.001°
• γ: 90°
• Cell volume: 3172.29 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0422
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.084
• Weighted residual factors for all reflections included in the refinement: 0.0891
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No