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Information card for entry 1551777
Preview
| Coordinates | 1551777.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H21 N3 O4 |
|---|---|
| Calculated formula | C23 H21 N3 O4 |
| SMILES | c1cccc2c1C(=O)N(C2=O)CCN(CCN1C(=O)c2c(C1=O)cccc2)CC=C |
| Title of publication | Synthesis and Crystal Structure of 2,2′-[(Allylimino)diethane-2,1-diyl]bisphthalimide |
| Authors of publication | LATXAGUE, Laurent; CHANSEAU, Christel; DURRIEU, Marie-Christine; MASSIP, Stéphane; LEGER, Jean-Michel |
| Journal of publication | X-ray Structure Analysis Online |
| Year of publication | 2009 |
| Journal volume | 25 |
| Pages of publication | 55 |
| a | 8.013 ± 0.006 Å |
| b | 32.731 ± 0.007 Å |
| c | 8.485 ± 0.002 Å |
| α | 90° |
| β | 113.5 ± 0.04° |
| γ | 90° |
| Cell volume | 2040.8 ± 1.8 Å3 |
| 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 | 0.1257 |
| Residual factor for significantly intense reflections | 0.0654 |
| Weighted residual factors for significantly intense reflections | 0.1665 |
| Weighted residual factors for all reflections included in the refinement | 0.2251 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216389 (current) | 2019-06-20 | cif/ Adding structures of 1551777 via cif-deposit CGI script. |
1551777.cif |
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