Information card for entry 4323160

Structure parameters

• Formula: C17 H27 O3 Tl
• Calculated formula: C17 H27 O3 Tl
• Title of publication: Synthesis and Structure of a Polymeric Complex of Tl(III) Containing Bis(semiquinone) Bridging Ligands
• Authors of publication: Gleb A. Abakumov; Vladimir K. Cherkasov; Vladimir I. Nevodchikov; Vyacheslav A. Kuropatov; Bruce C. Noll; Cortlandt G. Pierpont
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 6117 - 6119
• a: 12.7022 ± 0.0002 Å
• b: 12.6197 ± 0.0001 Å
• c: 23.011 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3688.62 ± 0.07 ų
• Cell temperature: 166 ± 2 K
• Ambient diffraction temperature: 166 ± 2 K
• Number of distinct elements: 4
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0435
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for all reflections: 0.0736
• Weighted residual factors for significantly intense reflections: 0.0647
• Goodness-of-fit parameter for all reflections: 1.066
• Goodness-of-fit parameter for significantly intense reflections: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No