Information card for entry 2008010

Structure parameters

• Chemical name: N-[α-(N-succimidyl)benzyl]selenamorpholine
• Formula: C15 H18 N2 O2 Se
• Calculated formula: C15 H18 N2 O2 Se
• SMILES: [Se]1CCN(CC1)C(N1C(=O)CCC1=O)c1ccccc1
• Title of publication: <i>N</i>-[α-(<i>N</i>-Succimidyl)benzyl]selenamorpholine
• Authors of publication: Wu, Jun; Liu, Xiu-Fang; Xu, Han-Sheng; Huang, Jing-Wei; Hu, Sheng-Zhi; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 12
• Pages of publication: IUC9800066
• a: 10.081 ± 0.001 Å
• b: 8.927 ± 0.001 Å
• c: 16.508 ± 0.001 Å
• α: 90°
• β: 102.29 ± 0.01°
• γ: 90°
• Cell volume: 1451.6 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.063
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for all reflections included in the refinement: 0.171
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No