Information card for entry 2201008

Structure parameters

• Chemical name: N-(5-Phenylseleno)pentylphthalimide
• Formula: C19 H19 N O2 Se
• Calculated formula: C19 H19 N O2 Se
• SMILES: [Se](CCCCCN1C(=O)c2ccccc2C1=O)c1ccccc1
• Title of publication: <i>N</i>-(5-Phenylseleno)pentylphthalimide
• Authors of publication: Wan-Xuan Zhang; Hai-Tao Yu; Dong-Ren Bai; Ji-Ben Meng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 3
• Pages of publication: o345 - o346
• a: 8.481 ± 0.002 Å
• b: 18.196 ± 0.005 Å
• c: 11.265 ± 0.003 Å
• α: 90°
• β: 99.361 ± 0.005°
• γ: 90°
• Cell volume: 1715.3 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.077
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.081
• Weighted residual factors for all reflections included in the refinement: 0.098
• Goodness-of-fit parameter for all reflections included in the refinement: 0.94
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes