Information card for entry 2220186

Structure parameters

• Chemical name: Bis(tetraphenylphosphonium) di-μ-iodido-bis[diiodidotellurate(II)]
• Formula: C48 H40 I6 P2 Te2
• Calculated formula: C48 H40 I6 P2 Te2
• SMILES: I[Te]1(I)[I][Te](I)(I)[I]1.[P+](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.[P+](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Bis(tetraphenylphosphonium) di-μ-iodido-bis[diiodidotellurate(II)]
• Authors of publication: Närhi, Sari M.; Oilunkaniemi, Raija; Laitinen, Risto S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: m1561
• a: 13.252 ± 0.003 Å
• b: 14.494 ± 0.003 Å
• c: 14.109 ± 0.003 Å
• α: 90°
• β: 107.48 ± 0.03°
• γ: 90°
• Cell volume: 2584.8 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0517
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.0995
• Weighted residual factors for all reflections included in the refinement: 0.107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes