Information card for entry 4320080

Structure parameters

• Formula: C28 H44 N2 O4 Ti
• Calculated formula: C28 H41.55 N2 O4 Ti
• Title of publication: Coordination Chemistry of Amine Bis(phenolate) Titanium Complexes: Tuning Complex Type and Structure by Ligand Modification
• Authors of publication: Edit Y. Tshuva; Israel Goldberg; Moshe Kol; Zeev Goldschmidt
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 4263 - 4270
• a: 10.802 ± 0.001 Å
• b: 23.345 ± 0.001 Å
• c: 11.384 ± 0.001 Å
• α: 90 ± 0.01°
• β: 102.897 ± 0.01°
• γ: 90 ± 0.01°
• Cell volume: 2798.3 ± 0.4 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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: 0.0669
• Residual factor for significantly intense reflections: 0.0559
• Weighted residual factors for significantly intense reflections: 0.161
• Weighted residual factors for all reflections included in the refinement: 0.171
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No