Information card for entry 7251292

Structure parameters

• Formula: C72 H45 B Cl2 F42 N3 Te
• Calculated formula: C72 H45 B Cl2 F42 N3 Te
• Title of publication: Supramolecular Assemblies Involving Triaryltelluronium Cations: Combining Chalcogen Bonding, Hydrogen Bonding and Lone Pair–pi Interactions
• Authors of publication: Groslambert, Loic; Padilla-Hernandez, Andres; Hasija, Avantika; Aubert, Emmanuel; Pale, Patrick; Mamane, Victor
• Journal of publication: CrystEngComm
• Year of publication: 2025
• a: 13.4842 ± 0.0011 Å
• b: 16.5143 ± 0.0014 Å
• c: 17.9535 ± 0.0016 Å
• α: 93.388 ± 0.002°
• β: 94.153 ± 0.003°
• γ: 98.039 ± 0.003°
• Cell volume: 3938.5 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1281
• Residual factor for significantly intense reflections: 0.0867
• Weighted residual factors for significantly intense reflections: 0.2137
• Weighted residual factors for all reflections included in the refinement: 0.2509
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No