Information card for entry 7021708

Structure parameters

• Formula: C48 H48 Br3 F6 N4 P Te2
• Calculated formula: C48 H48 Br3 F6 N4 P Te2
• SMILES: CN(C)c1cccc2cccc([Te]3(Br)c4c5c([N]3(C)C)cccc5ccc4)c12.[P](F)(F)(F)(F)(F)[F-].[Br-].CN(C)c1cccc2cccc(c12)[Te]1(Br)c2cccc3cccc([N]1(C)C)c23
• Title of publication: Diarylhalotelluronium(iv) cations [(8-Me2NC10H6)2TeX](+) (X = Cl, Br, I) stabilized by intramolecularly coordinating N-donor substituents.
• Authors of publication: Beckmann, Jens; Bolsinger, Jens; Duthie, Andrew; Finke, Pamela
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 34
• Pages of publication: 12193 - 12202
• a: 15.915 ± 0.018 Å
• b: 9.941 ± 0.007 Å
• c: 16.361 ± 0.013 Å
• α: 90°
• β: 110.84 ± 0.08°
• γ: 90°
• Cell volume: 2419 ± 4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1625
• Residual factor for significantly intense reflections: 0.0628
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.133
• Goodness-of-fit parameter for all reflections included in the refinement: 0.846
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No