Information card for entry 8000087

Structure parameters

• Formula: C27 H37 Cl2 O8 Si4 Ti2
• Calculated formula: C27 H37 Cl2 O8 Si4 Ti2
• Title of publication: Synthesis and Structures of the First Titanium(IV) Complexes with Cyclic Tetrasiloxide Ligands: Incomplete and Complete Cage Titanosiloxanes
• Authors of publication: Hirotsu, Masakazu; Taruno, Shinsuke; Yoshimura, Takashi; Ueno, Keiji; Unno, Masafumi; Matsumoto, Hideyuki
• Journal of publication: Chemistry Letters
• Year of publication: 2005
• Journal volume: 34
• Journal issue: 11
• Pages of publication: 1542
• a: 13.071 ± 0.008 Å
• b: 13.186 ± 0.011 Å
• c: 13.487 ± 0.011 Å
• α: 115.471 ± 0.01°
• β: 95.79 ± 0.009°
• γ: 114.59 ± 0.01°
• Cell volume: 1794 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0451
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for significantly intense reflections: 0.1273
• Weighted residual factors for all reflections included in the refinement: 0.1311
• Goodness-of-fit parameter for all reflections included in the refinement: 0.968
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No