Information card for entry 2208166

Structure parameters

• Chemical name: 1-(Adamant-1-yloxy)pyridin-2(1H)-one
• Formula: C15 H18 N O2
• Calculated formula: C15 H18 N O2
• Title of publication: 1-(1-Adamantyloxy)pyridin-2(1<i>H</i>)-one
• Authors of publication: Hartung, Jens; Svoboda, Ingrid; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 2
• Pages of publication: o579 - o581
• a: 16.982 ± 0.003 Å
• b: 6.559 ± 0.003 Å
• c: 11.237 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1251.6 ± 0.7 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.2734
• Residual factor for significantly intense reflections: 0.082
• Weighted residual factors for significantly intense reflections: 0.2354
• Weighted residual factors for all reflections included in the refinement: 0.303
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes