Information card for entry 7116754

Structure parameters

• Formula: C28 H34 B2 O4 Te
• Calculated formula: C28 H34 B2 O4 Te
• SMILES: [Te]1C(=C(C(=C1c1ccccc1)B1OC(C(O1)(C)C)(C)C)c1ccccc1)B1OC(C(O1)(C)C)(C)C
• Title of publication: Phosphorescence within benzotellurophenes and color tunable tellurophenes under ambient conditions
• Authors of publication: Gang He; Benjamin D. Wiltshire; Paul Choi; Aliaksandr Savin; Shuai Sun; Arash Mohammadpour; Michael J. Ferguson; Robert McDonald; Samira Farsinezhad; Alex Brown; Karthik Shankar; Eric Rivard
• Journal of publication: Chem.Commun.
• Year of publication: 2015
• Journal volume: 51
• Pages of publication: 5444
• a: 7.0792 ± 0.0011 Å
• b: 12.1454 ± 0.0019 Å
• c: 16.953 ± 0.003 Å
• α: 75.2698 ± 0.0017°
• β: 82.0304 ± 0.0019°
• γ: 80.2126 ± 0.0019°
• Cell volume: 1382.2 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0353
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0776
• Weighted residual factors for all reflections included in the refinement: 0.0796
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No