Information card for entry 4311652

Structure parameters

• Formula: C69.5 H79 N O15 P6 Ti3
• Calculated formula: C69.5 H75 N O15 P6 Ti3
• Title of publication: Synthesis, Structures, and Solution Behavior of Di- and Trinuclear Titanium(IV)-Cyclophosphato Complexes
• Authors of publication: Sou Kamimura; Tsukasa Matsunaga; Shigeki Kuwata; Masakazu Iwasaki; Youichi Ishii
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 6127 - 6129
• a: 11.2743 ± 0.0009 Å
• b: 13.313 ± 0.001 Å
• c: 26.442 ± 0.002 Å
• α: 79.799 ± 0.003°
• β: 89.912 ± 0.005°
• γ: 65.218 ± 0.002°
• Cell volume: 3534.6 ± 0.5 ų
• Cell temperature: 103.2 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 significantly intense reflections: 0.0551
• Weighted residual factors for all reflections included in the refinement: 0.1214
• Goodness-of-fit parameter for all reflections included in the refinement: 1.445
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No