Information card for entry 7134897

Structure parameters

• Formula: C38 H29 B2 F8 N3 Se2
• Calculated formula: C38 H29 B2 F8 N3 Se2
• Title of publication: <i>Se</i>-Aryl-<i>N</i>-phenylphenoselenazinium salts: aryl radical precursors incorporating a photosensitizer unit.
• Authors of publication: Kurokawa, Takuma; Takahashi, Shintaro; Kano, Naokazu
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 75
• Pages of publication: 14454 - 14457
• a: 12.7389 ± 0.0005 Å
• b: 12.6882 ± 0.0004 Å
• c: 21.5602 ± 0.0007 Å
• α: 90°
• β: 97.428 ± 0.003°
• γ: 90°
• Cell volume: 3455.6 ± 0.2 ų
• Cell temperature: 101 ± 1 K
• Ambient diffraction temperature: 101 ± 1 K
• Number of distinct elements: 6
• 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: 0.0916
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.0985
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No