Information card for entry 8105728

Structure parameters

• Formula: C18 H14 N2 O3
• Calculated formula: C18 H14 N2 O3
• Title of publication: The crystal structure of 2-(benzhydryloxy)-3-nitropyridine, C18H14N2O3
• Authors of publication: Lu, Zhi-Qiang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2022
• Journal volume: 237
• Journal issue: 3
• Pages of publication: 479 - 480
• a: 8.1644 ± 0.0003 Å
• b: 14.5766 ± 0.0006 Å
• c: 12.9462 ± 0.0004 Å
• α: 90°
• β: 91.902 ± 0.003°
• γ: 90°
• Cell volume: 1539.87 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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 all reflections: 0.0674
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1527
• Weighted residual factors for all reflections included in the refinement: 0.1673
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No