Information card for entry 7714399

Structure parameters

• Chemical name: tris(p-methoxyphenyl)Telluronium tetraflouroborate
• Formula: C21 H21 B F4 O3 Te
• Calculated formula: C21 H21 B F4 O3 Te
• SMILES: [Te+](c1ccc(OC)cc1)(c1ccc(OC)cc1)c1ccc(OC)cc1.[B](F)(F)(F)[F-]
• Title of publication: Electrocatalytic Hydrogen Evolution Mediated by an Organotelluroxane Macrocycle Stabilized through Secondary Interactions
• Authors of publication: Narsimhulu, Gujju; Samuel, Calvin; Sathish, Palani; Dasari, Sai Hemanth Kumar; Krishnamoorthy, Kothandam; Viswanathan, Baskar
• Journal of publication: Dalton Transactions
• Year of publication: 2023
• a: 10.2455 ± 0.0002 Å
• b: 10.5162 ± 0.0002 Å
• c: 10.9829 ± 0.0002 Å
• α: 110.245 ± 0.002°
• β: 97.955 ± 0.001°
• γ: 104.283 ± 0.001°
• Cell volume: 1042.82 ± 0.04 ų
• Cell temperature: 106 ± 9 K
• Ambient diffraction temperature: 106 ± 9 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0294
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0595
• Weighted residual factors for all reflections included in the refinement: 0.061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No