Information card for entry 7220839

Structure parameters

• Common name: (Z)-(mesityl)(2-methoxycarbonylvinyl)telluride
• Chemical name: (Z)-Methyl 2-(2',4',6'-trimethylphenylltelluro)acrylate
• Formula: C13 H16 O2 Te
• Calculated formula: C13 H16 O2 Te
• SMILES: [Te](c1c(cc(cc1C)C)C)/C=C\C(=O)OC
• Title of publication: Hydrotelluration of acetylenic Esters: Structural Characterization of Stereoisomers of Methyl/ethyl (β-aryltelluro)acrylates
• Authors of publication: Chauhan, Ashok Kumar Singh; Singh, Bandana; Srivastava, Ramesh Chandra; Duthie, Andrew; Butcher, Ray Jay
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 5.63177 ± 0.00009 Å
• b: 15.3211 ± 0.0003 Å
• c: 15.0625 ± 0.0003 Å
• α: 90°
• β: 98.5658 ± 0.0019°
• γ: 90°
• Cell volume: 1285.17 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0481
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0716
• Weighted residual factors for all reflections included in the refinement: 0.0799
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No