Information card for entry 1576020

Structure parameters

• Formula: C19 H11 As S
• Calculated formula: C19 H11 As S
• Title of publication: Synthesis of dibenzoarsole derivatives from biarylborates <i>via</i> the twofold formation of C-As bonds using arsenium dication equivalents.
• Authors of publication: Nishimura, Kazutoshi; Iwamoto, Hiroki; Nishii, Yuji; Hirano, Koji
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 45
• Pages of publication: 21433 - 21439
• a: 7.6593 ± 0.0005 Å
• b: 8.7731 ± 0.0006 Å
• c: 11.3505 ± 0.0008 Å
• α: 70.661 ± 0.006°
• β: 83.531 ± 0.006°
• γ: 83.032 ± 0.006°
• Cell volume: 712.21 ± 0.09 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0753
• Residual factor for significantly intense reflections: 0.0697
• Weighted residual factors for significantly intense reflections: 0.181
• Weighted residual factors for all reflections included in the refinement: 0.1901
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No