Information card for entry 7128117

Structure parameters

• Formula: C30 H22 N4 Te2
• Calculated formula: C30 H22 N4 Te2
• Title of publication: Supramolecular rectangles through directional chalcogen bonding.
• Authors of publication: Dhaka, Arun; Jeannin, Olivier; Aubert, Emmanuel; Espinosa, Enrique; Fourmigué, Marc
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 37
• Pages of publication: 4560 - 4563
• a: 10.8282 ± 0.0019 Å
• b: 24.258 ± 0.004 Å
• c: 11.763 ± 0.002 Å
• α: 90°
• β: 115.48 ± 0.006°
• γ: 90°
• Cell volume: 2789.3 ± 0.8 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 4
• 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: 0.099
• Residual factor for significantly intense reflections: 0.0776
• Weighted residual factors for significantly intense reflections: 0.1612
• Weighted residual factors for all reflections included in the refinement: 0.1725
• Goodness-of-fit parameter for all reflections included in the refinement: 1.24
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No