Information card for entry 7011782

Structure parameters

• Formula: C36 H88 Cl16 N8 Ti4
• Calculated formula: C36 H88 Cl16 N8 Ti4
• Title of publication: Titanium imido complexes as precursors to titanium nitride
• Authors of publication: Carmalt, Claire J.; Newport, Anne C.; Parkin, Ivan P.; White, Andrew J. P.; Williams, David J.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 21
• Pages of publication: 4055
• a: 12.3997 ± 0.0012 Å
• b: 12.952 ± 0.003 Å
• c: 13.5091 ± 0.0013 Å
• α: 63.134 ± 0.01°
• β: 63.229 ± 0.008°
• γ: 87.769 ± 0.009°
• Cell volume: 1690.6 ± 0.5 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0617
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for all reflections: 0.1221
• Weighted residual factors for significantly intense reflections: 0.112
• Goodness-of-fit parameter for all reflections: 1.047
• Goodness-of-fit parameter for significantly intense reflections: 1.084
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No