Information card for entry 2237323

Structure parameters

• Chemical name: Tetrabromo[4-(triphenylphosphanyloxy)butyl]tellurium acetonitrile monosolvate
• Formula: C24 H26 Br4 N O P Te
• Calculated formula: C24 H26 Br4 N O P Te
• SMILES: [Te](Br)(Br)(Br)(Br)CCCCO[P+](c1ccccc1)(c1ccccc1)c1ccccc1.N#CC
• Title of publication: Tetrabromido[4-(triphenylphosphanyloxy)butyl]tellurium acetonitrile monosolvate
• Authors of publication: Närhi, Sari M.; Oilunkaniemi, Raija; Laitinen, Risto S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 2
• Pages of publication: m88
• a: 9.3195 ± 0.0019 Å
• b: 13.899 ± 0.003 Å
• c: 21.962 ± 0.004 Å
• α: 90°
• β: 94.92 ± 0.03°
• γ: 90°
• Cell volume: 2834.3 ± 1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• 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: 0.066
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.1162
• Weighted residual factors for all reflections included in the refinement: 0.1345
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes