Information card for entry 4331554

Structure parameters

• Formula: C152 H40 Cu5 F100 O22 Tl10
• Calculated formula: C152 H40 Cu5 F100 O22 Tl10
• Title of publication: Thallophilic Interactions in Aryloxide Compounds: the {Tl2(μ2-OAr)4} Structural Motif in (TlOAr)4and Tl2Cu(OAr)4Compounds
• Authors of publication: Childress, Montana V.; Millar, David; Alam, Todd M.; Kreisel, Kevin A.; Yap, Glenn P. A.; Zakharov, Lev N.; Golen, James A.; Rheingold, Arnold L.; Doerrer, Linda H.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 10
• Pages of publication: 3864 - 3877
• a: 14.858 ± 0.0008 Å
• b: 20.1452 ± 0.0011 Å
• c: 28.5113 ± 0.0016 Å
• α: 96.734 ± 0.001°
• β: 94.611 ± 0.001°
• γ: 93.648 ± 0.001°
• Cell volume: 8424.6 ± 0.8 ų
• Cell temperature: 218 ± 2 K
• Ambient diffraction temperature: 218 ± 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: 0.1152
• Residual factor for significantly intense reflections: 0.0658
• Weighted residual factors for significantly intense reflections: 0.1485
• Weighted residual factors for all reflections included in the refinement: 0.1694
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No