Information card for entry 4069189

Structure parameters

• Common name: Titanium
• Chemical name: Titanium amide chloride
• Formula: C12 H36 Cl2 N2 Si4 Ti
• Calculated formula: C12 H36 Cl2 N2 Si4 Ti
• SMILES: C[Si](C)(C)N([Si](C)(C)C)[Ti](Cl)(Cl)N([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Synthesis and Characterization of Group 4 Amide Chloride and Amide Imide Complexes
• Authors of publication: Yu, Xianghua; Chen, Shu-Jian; Wang, Xiaoping; Chen, Xue-Tai; Xue, Zi-Ling
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 15
• Pages of publication: 4269
• a: 12.562 ± 0.005 Å
• b: 13.279 ± 0.005 Å
• c: 14.745 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2459.6 ± 1.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0403
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.1063
• Weighted residual factors for all reflections included in the refinement: 0.1123
• Goodness-of-fit parameter for all reflections included in the refinement: 0.881
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No