Information card for entry 4067901

Structure parameters

• Formula: C27 H36 N2 O8 Te2
• Calculated formula: C27 H36 N2 O8 Te2
• SMILES: O([Te]1(=O)(OC)([N](C)(C)c2c3c(ccc2)cccc13)O)[Te]1(OC)(=O)(O)c2cccc3c2c([N]1(C)C)ccc3.OC
• Title of publication: Synthesis and Structure of an Intramolecularly Coordinated Diaryltelluronic Acid and Its Dimethyl Ester
• Authors of publication: Beckmann, Jens; Bolsinger, Jens; Duthie, Andrew; Finke, Pamela
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 1
• Pages of publication: 289
• a: 10.982 ± 0.008 Å
• b: 23.84 ± 0.02 Å
• c: 11.868 ± 0.009 Å
• α: 90°
• β: 111.15 ± 0.06°
• γ: 90°
• Cell volume: 2898 ± 4 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1225
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1316
• Weighted residual factors for all reflections included in the refinement: 0.1474
• Goodness-of-fit parameter for all reflections included in the refinement: 0.879
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No