Information card for entry 4327197

Structure parameters

• Formula: C30 H54 N6 P3 Ti
• Calculated formula: C30 H54 N6 P3 Ti
• Title of publication: Synthesis and Structural Characterization of 1,2,4-Diazaphospholide Complexes of Titanium(IV) and Titanium(III)
• Authors of publication: Wenjun Zheng; Ibon Alkorta; Dongming Yang; Li Wan; Mingang Zhao; José Elguero
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 12408 - 12410
• a: 10.321 ± 0.005 Å
• b: 12.592 ± 0.006 Å
• c: 16.792 ± 0.008 Å
• α: 77.521 ± 0.007°
• β: 76.365 ± 0.008°
• γ: 70.433 ± 0.007°
• Cell volume: 1975.8 ± 1.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.1511
• Residual factor for significantly intense reflections: 0.0992
• Weighted residual factors for significantly intense reflections: 0.211
• Weighted residual factors for all reflections included in the refinement: 0.2402
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No