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Information card for entry 7230551
Preview
| Coordinates | 7230551.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C26 H19 Cl N2 O3 S |
|---|---|
| Calculated formula | C26 H19 Cl N2 O3 S |
| Title of publication | One-pot sequential multicomponent reaction between in situ generated aldimines and succinaldehyde: facile synthesis of substituted pyrrole-3-carbaldehydes and applications towards medicinally important fused heterocycles |
| Authors of publication | Singh, Anoop; Mir, Nisar A.; Choudhary, Sachin; Singh, Deepika; Sharma, Preetika; Kant, Rajni; Kumar, Indresh |
| Journal of publication | RSC Advances |
| Year of publication | 2018 |
| Journal volume | 8 |
| Journal issue | 28 |
| Pages of publication | 15448 |
| a | 9.9462 ± 0.0007 Å |
| b | 15.4122 ± 0.0009 Å |
| c | 15.2477 ± 0.0011 Å |
| α | 90° |
| β | 96.432 ± 0.007° |
| γ | 90° |
| Cell volume | 2322.7 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0945 |
| Residual factor for significantly intense reflections | 0.0515 |
| Weighted residual factors for significantly intense reflections | 0.1143 |
| Weighted residual factors for all reflections included in the refinement | 0.1347 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7230551.cif |
| 207462 | 2018-04-24 | cif/ Adding structures of 7230550, 7230551 via cif-deposit CGI script. |
7230551.cif |
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Users of the data should acknowledge the original authors of the
structural data.