Information card for entry 4330975

Structure parameters

• Formula: C54 Cl8 N2 O10 Ti2
• Calculated formula: C54 Cl8 N2 O10 Ti2
• Title of publication: Coordination Chemistry of N,N,N',N'-Tetrakis(3,5-substituted benzyl-2-oxide)-2,2'-(ethylenedioxy)diethanamine Modified Group 4 Metal Alkoxides
• Authors of publication: Timothy J. Boyle; Daniel T. Yonemoto; Leigh Anna Steele; Joshua Farrell; Peter Renehan; Taylor Huhta
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 12023 - 12031
• a: 11.1671 ± 0.0014 Å
• b: 14.0685 ± 0.0017 Å
• c: 21.67 ± 0.003 Å
• α: 72.97 ± 0.002°
• β: 82.35 ± 0.002°
• γ: 70.906 ± 0.002°
• Cell volume: 3073.5 ± 0.7 ų
• Cell temperature: 188 ± 2 K
• Ambient diffraction temperature: 188 ± 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: 0.1318
• Residual factor for significantly intense reflections: 0.0715
• Weighted residual factors for significantly intense reflections: 0.1822
• Weighted residual factors for all reflections included in the refinement: 0.2175
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No