Information card for entry 7019954

Structure parameters

• Formula: C11 H12 Cl3 N O Te
• Calculated formula: C11 H12 Cl3 N O Te
• SMILES: Cl[Te]1(Cl)(Cl)[N]2=C(OC[C@H]2CC)c2c1cccc2
• Title of publication: Isolation and molecular structures of novel organotellurium(iv) halides, oxyhalide and mixed halide.
• Authors of publication: Rakesh, Prakul; Singh, Harkesh B.; Butcher, Ray J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 35
• Pages of publication: 10707 - 10714
• a: 8.8565 ± 0.0002 Å
• b: 12.1571 ± 0.0003 Å
• c: 13.2983 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1431.82 ± 0.06 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0329
• Residual factor for significantly intense reflections: 0.0264
• Weighted residual factors for significantly intense reflections: 0.0484
• Weighted residual factors for all reflections included in the refinement: 0.0497
• Goodness-of-fit parameter for all reflections included in the refinement: 0.967
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No