Information card for entry 7019959

Structure parameters

• Formula: C9 H12 Br2.37 Cl0.63 N Te
• Calculated formula: C9 H12 Br2.37 Cl0.63 N Te
• 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: 14.7827 ± 0.0008 Å
• b: 12.0157 ± 0.0005 Å
• c: 15.8651 ± 0.0007 Å
• α: 90°
• β: 109.13 ± 0.005°
• γ: 90°
• Cell volume: 2662.4 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.108
• Residual factor for significantly intense reflections: 0.0928
• Weighted residual factors for significantly intense reflections: 0.2428
• Weighted residual factors for all reflections included in the refinement: 0.2705
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No