Information card for entry 4320906

Structure parameters

• Chemical name: [Ti(NBu-t){Me3SiN(CH2CH2NSiMe3)2}(py)]
• Formula: C22 H49 N5 Si3 Ti
• Calculated formula: C22 H49 N5 Si3 Ti
• SMILES: [Ti]12(=NC(C)(C)C)(N([Si](C)(C)C)CC[N]1([Si](C)(C)C)CCN2[Si](C)(C)C)[n]1ccccc1
• Title of publication: Titanium and Niobium Imido Complexes Derived from Diamidoamine Ligands
• Authors of publication: Philip E. Collier; Stephen M. Pugh; Howard S. C. Clark; Jason B. Love; Alexander J. Blake; F. Geoffrey N. Cloke; Philip Mountford
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 2001 - 2005
• a: 9.857 ± 0.004 Å
• b: 19.382 ± 0.004 Å
• c: 16.339 ± 0.005 Å
• α: 90°
• β: 102.26 ± 0.04°
• γ: 90°
• Cell volume: 3050.3 ± 1.7 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0722
• Residual factor for significantly intense reflections: 0.062
• Weighted residual factors for all reflections: 0.1231
• Weighted residual factors for significantly intense reflections: 0.111
• Goodness-of-fit parameter for all reflections: 0.72
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No