Information card for entry 4308482

Structure parameters

• Formula: C17 H44 Cl N5 Si2 Ti
• Calculated formula: C17 H44 Cl N5 Si2 Ti
• SMILES: [Ti]1(Cl)([N](=C(N1C(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(C)C)(N(C)C)N(C)C
• Title of publication: Synthesis of Titanium(IV) Guanidinate Complexes and the Formation of Titanium Carbonitride via Low-Pressure Chemical Vapor Deposition
• Authors of publication: Claire J. Carmalt; Anne C. Newport; Shane A. O'Neill; Ivan P. Parkin; Andrew J. P. White; David J. Williams
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 615 - 619
• a: 10.139 ± 0.003 Å
• b: 14.614 ± 0.003 Å
• c: 18.034 ± 0.004 Å
• α: 90°
• β: 99.81 ± 0.02°
• γ: 90°
• Cell volume: 2633.1 ± 1.1 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1293
• Residual factor for significantly intense reflections: 0.0753
• Weighted residual factors for all reflections: 0.2196
• Weighted residual factors for significantly intense reflections: 0.179
• Goodness-of-fit parameter for all reflections: 1.09
• Goodness-of-fit parameter for significantly intense reflections: 1.19
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No