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Information card for entry 7235343
Preview
| Coordinates | 7235343.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C22 H18 Cl2 N2 |
|---|---|
| Calculated formula | C22 H18 Cl2 N2 |
| Title of publication | An efficient facile and one-pot synthesis of benzodiazepines and chemoselective 1,2-disubstituted benzimidazoles using a magnetically retrievable Fe3O4 nanocatalyst under solvent free conditions |
| Authors of publication | Jamatia, Ramen; Saha, Mithu; Pal, Amarta Kumar |
| Journal of publication | RSC Adv. |
| Year of publication | 2014 |
| Journal volume | 4 |
| Journal issue | 25 |
| Pages of publication | 12826 |
| a | 14.0976 ± 0.0012 Å |
| b | 10.017 ± 0.0007 Å |
| c | 14.9301 ± 0.0013 Å |
| α | 90° |
| β | 116.746 ± 0.011° |
| γ | 90° |
| Cell volume | 1882.8 ± 0.3 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/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0979 |
| Residual factor for significantly intense reflections | 0.0548 |
| Weighted residual factors for significantly intense reflections | 0.1174 |
| Weighted residual factors for all reflections included in the refinement | 0.1375 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.018 |
| 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. |
7235343.cif |
| 232705 | 2019-11-23 | cif/ Adding structures of 7235343 via cif-deposit CGI script. |
7235343.cif |
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Users of the data should acknowledge the original authors of the
structural data.