Information card for entry 2205550

Structure parameters

• Chemical name: N,N'-ethylenedisuccinimide
• Formula: C10 H12 N2 O4
• Calculated formula: C10 H12 N2 O4
• SMILES: O=C1CCC(=O)N1CCN1C(=O)CCC1=O
• Title of publication: <i>N</i>,<i>N</i>'-Ethylenedisuccinimide
• Authors of publication: Christopher L. Brown; Sarah J. Atkinson; Peter C. Healy
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 4
• Pages of publication: o1072 - o1073
• a: 12.5653 ± 0.0013 Å
• b: 8.3613 ± 0.001 Å
• c: 9.9285 ± 0.0015 Å
• α: 90°
• β: 90.694 ± 0.01°
• γ: 90°
• Cell volume: 1043 ± 0.2 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 4
• 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: 0.0657
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for significantly intense reflections: 0.124
• Weighted residual factors for all reflections included in the refinement: 0.1367
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes