Information card for entry 7062748

Structure parameters

• Formula: C28 H34 Cl6 F6 N2 O2 Te
• Calculated formula: C28 H34 Cl6 F6 N2 O2 Te
• Title of publication: Unusual tellurium(iv) mediated cyclisation diols into dihydroxazoles with potential anticancer activity
• Authors of publication: D’Arcy, Kenneth; Schäfer, Tim; De Franco, Michele; Ricco, Raffaele; Gandin, Valentina; Sanz Miguel, Pablo J.; Montagner, Diego
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 39
• Pages of publication: 18485 - 18491
• a: 19.5893 ± 0.0016 Å
• b: 7.4413 ± 0.0006 Å
• c: 23.8477 ± 0.0019 Å
• α: 90°
• β: 90.8384 ± 0.0012°
• γ: 90°
• Cell volume: 3475.9 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0219
• Residual factor for significantly intense reflections: 0.0198
• Weighted residual factors for significantly intense reflections: 0.0478
• Weighted residual factors for all reflections included in the refinement: 0.0487
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No