Information card for entry 4311605

Structure parameters

• Common name: (8) [Ti2Rb2(ONep)6(DMP)4]inf*THF
• Formula: C39 H67 O7 Rb Ti
• Calculated formula: C31 H51 O5 Rb Ti
• SMILES: O([Ti](OCC(C)(C)C)(OCC(C)(C)C)(OCC(C)(C)C)Oc1c(cccc1C)C)c1c(cccc1C)C.[Rb+]
• Title of publication: Synthesis and Characterization of a Series of Rubidium Alkoxides and Rubidium-Titanium Double Alkoxides
• Authors of publication: Scott D. Bunge; Timothy J. Boyle; Harry D. Pratt; Todd M. Alam; Mark A. Rodriguez
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 6035 - 6041
• a: 13.986 ± 0.004 Å
• b: 13.874 ± 0.004 Å
• c: 20.684 ± 0.006 Å
• α: 90°
• β: 101.688 ± 0.007°
• γ: 90°
• Cell volume: 3930 ± 2 ų
• Cell temperature: 178 ± 2 K
• Ambient diffraction temperature: 178 ± 2 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: 0.1446
• Residual factor for significantly intense reflections: 0.1102
• Weighted residual factors for significantly intense reflections: 0.266
• Weighted residual factors for all reflections included in the refinement: 0.288
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No