Information card for entry 4311604

Structure parameters

• Common name: (7) [Rb(DMP)Ti(DMP)4]inf
• Formula: C40 H45 O5 Rb Ti
• Calculated formula: C40 H45 O5 Rb Ti
• SMILES: c1(c(cccc1C)C)O[Ti](Oc1c(cccc1C)C)(Oc1c(cccc1C)C)(Oc1c(cccc1C)C)Oc1c(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: 17.101 ± 0.002 Å
• b: 10.5715 ± 0.0014 Å
• c: 19.698 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3561.1 ± 0.8 ų
• Cell temperature: 178 ± 2 K
• Ambient diffraction temperature: 178 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0703
• Residual factor for significantly intense reflections: 0.0532
• Weighted residual factors for significantly intense reflections: 0.0855
• Weighted residual factors for all reflections included in the refinement: 0.0901
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No