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Information card for entry 7239354
Preview
| Coordinates | 7239354.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C26 H20 N6 O2 |
|---|---|
| Calculated formula | C26 H20 N6 O2 |
| Title of publication | A binuclear Mn(ii) complex as an efficient catalyst for transamidation of carboxamides with amines |
| Authors of publication | Singh, Divya Pratap; Allam, Bharat Kumar; Singh, Krishna Nand; Singh, Vinod Prasad |
| Journal of publication | RSC Adv. |
| Year of publication | 2014 |
| Journal volume | 4 |
| Journal issue | 3 |
| Pages of publication | 1155 |
| a | 10 ± 0.001 Å |
| b | 15.6555 ± 0.0016 Å |
| c | 16.5447 ± 0.0016 Å |
| α | 115.226 ± 0.01° |
| β | 101.302 ± 0.008° |
| γ | 98.774 ± 0.009° |
| Cell volume | 2214.9 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.3186 |
| Residual factor for significantly intense reflections | 0.0766 |
| Weighted residual factors for significantly intense reflections | 0.0814 |
| Weighted residual factors for all reflections included in the refinement | 0.1401 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.91 |
| 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. |
7239354.cif |
| 244666 | 2019-11-28 | cif/ Adding structures of 7239354, 7239355 via cif-deposit CGI script. |
7239354.cif |
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Users of the data should acknowledge the original authors of the
structural data.