Information card for entry 4021815

Structure parameters

• Formula: C23 H18 O2 Se
• Calculated formula: C23 H18 O2 Se
• Title of publication: Structures of 1-(Arylseleninyl)naphthalenes: O, G, and Y Dependences in 8-G-1-[p-YC~6~H~4~Se(O)]C~10~H~6~
• Authors of publication: Satoko Hayashi; Hideki Wada; Takashi Ueno; Waro Nakanishi
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2006
• Journal volume: 71
• Pages of publication: 5574 - 5585
• a: 8.365 ± 0.003 Å
• b: 5.537 ± 0.002 Å
• c: 38.84 ± 0.003 Å
• α: 90°
• β: 94.81 ± 0.02°
• γ: 90°
• Cell volume: 1792.8 ± 1 ų
• Cell temperature: 292.2 K
• Ambient diffraction temperature: 292.2 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 significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.0329
• Goodness-of-fit parameter for significantly intense reflections: 1.568
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No