Information card for entry 1555319

Structure parameters

• Formula: C22 H17 As
• Calculated formula: C22 H17 As
• SMILES: [As]1(C(=CC=C1c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: Practical Synthesis and Properties of 2,5-Diarylarsoles.
• Authors of publication: Ishidoshiro, Makoto; Matsumura, Yoshimasa; Imoto, Hiroaki; Irie, Yasuyuki; Kato, Takuji; Watase, Seiji; Matsukawa, Kimihiro; Inagi, Shinsuke; Tomita, Ikuyoshi; Naka, Kensuke
• Journal of publication: Organic letters
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 19
• Pages of publication: 4854 - 4857
• a: 12.2262 ± 0.0004 Å
• b: 6.03311 ± 0.00018 Å
• c: 12.5465 ± 0.0005 Å
• α: 90°
• β: 115.216 ± 0.001°
• γ: 90°
• Cell volume: 837.26 ± 0.05 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for all reflections included in the refinement: 0.0409
• Goodness-of-fit parameter for all reflections included in the refinement: 1.205
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No