Information card for entry 2022122

Structure parameters

• Chemical name: {Diiodo[(phenyltellanyl)selanyl]-λ^4^-tellanyl}benzene
• Formula: C12 H10 I2 Se Te2
• Calculated formula: C12 H10 I2 Se Te2
• SMILES: [Te](I)(I)([Se][Te]c1ccccc1)c1ccccc1
• Title of publication: Chimeric supramolecular synthons in Ph~2~Te~2~(I~2~)Se
• Authors of publication: Torubaev, Yury V.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 6
• a: 12.98 ± 0.003 Å
• b: 16.037 ± 0.003 Å
• c: 7.8571 ± 0.0016 Å
• α: 90°
• β: 92.406 ± 0.003°
• γ: 90°
• Cell volume: 1634.1 ± 0.6 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• 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: 0.093
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.0684
• Weighted residual factors for all reflections included in the refinement: 0.0809
• Goodness-of-fit parameter for all reflections included in the refinement: 0.979
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes