Information card for entry 4021816

Structure parameters

• Formula: C16 H11 Cl O Se
• Calculated formula: C16 H11 Cl O 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: 9.167 ± 0.001 Å
• b: 10.057 ± 0.002 Å
• c: 7.759 ± 0.001 Å
• α: 106.35 ± 0.01°
• β: 97.32 ± 0.01°
• γ: 84.94 ± 0.01°
• Cell volume: 679.8 ± 0.2 ų
• Cell temperature: 292.2 K
• Ambient diffraction temperature: 292.2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.0314
• Goodness-of-fit parameter for significantly intense reflections: 1.156
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No