Information card for entry 7001266

Structure parameters

• Common name: Uranium(IV) diiodo bis(2,6-dimethylphenol) tris(tetrahydrofuran)
• Formula: C36 H58 I2 O7 U
• Calculated formula: C36 H58 I2 O7 U
• SMILES: c1(c(cccc1C)C)O[U](I)([O]1CCCC1)(I)(Oc1c(cccc1C)C)([O]1CCCC1)[O]1CCCC1.O1CCCC1.O1CCCC1
• Title of publication: Reactivity of UI4(OEt2)2 with phenols: probing the chemistry of the U‒I bond
• Authors of publication: Schnaars, David D.; Wu, Guang; Hayton, Trevor W.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 19
• Pages of publication: 3681 - 3687
• a: 13.6892 ± 0.0018 Å
• b: 11.8797 ± 0.0015 Å
• c: 24.995 ± 0.003 Å
• α: 90°
• β: 93.13 ± 0.003°
• γ: 90°
• Cell volume: 4058.7 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1025
• Residual factor for significantly intense reflections: 0.0563
• Weighted residual factors for significantly intense reflections: 0.1177
• Weighted residual factors for all reflections included in the refinement: 0.1429
• Goodness-of-fit parameter for all reflections included in the refinement: 0.917
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No