Information card for entry 7132797

Structure parameters

• Common name: Thesis - Compound A.10 - CO47
• Chemical name: CO47
• Formula: C24 H27 B N8 O2 Te W
• Calculated formula: C24 H27 B N8 O2 Te W
• SMILES: [W]12([n]3n(c(cc3C)C)[BH](n3[n]1c(cc3C)C)n1[n]2c(C)cc1C)(C#[O])(#C[Te]C#Cc1n(cnc1)C)C#[O]
• Title of publication: Carbon-chalcogen wires: alkynyltellurolatocarbynes.
• Authors of publication: Onn, Chee S.; Hill, Anthony F.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 26
• Pages of publication: 3555 - 3558
• a: 7.9095 ± 0.0002 Å
• b: 18.2594 ± 0.0004 Å
• c: 9.7522 ± 0.0003 Å
• α: 90°
• β: 99.742 ± 0.002°
• γ: 90°
• Cell volume: 1388.13 ± 0.06 ų
• Cell temperature: 149.99 ± 0.1 K
• Ambient diffraction temperature: 149.99 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0532
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.1347
• Weighted residual factors for all reflections included in the refinement: 0.1359
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No