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Information card for entry 7239325
Preview
| Coordinates | 7239325.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C27 H20 N4 O2 |
|---|---|
| Calculated formula | C27 H20 N4 O2 |
| Title of publication | Copper oxide nanoparticle mediated ‘click chemistry’ for the synthesis of mono-, bis- and tris-triazole derivatives from 10,10-dipropargyl-9-anthrone as a key building block |
| Authors of publication | Bagdi, Prasanta Ray; Basha, R. Sidick; Baruah, Pranjal Kumar; Khan, Abu T. |
| Journal of publication | RSC Advances |
| Year of publication | 2014 |
| Journal volume | 4 |
| Journal issue | 21 |
| Pages of publication | 10652 |
| a | 12.4688 ± 0.0007 Å |
| b | 10.2492 ± 0.0006 Å |
| c | 16.9379 ± 0.0009 Å |
| α | 90° |
| β | 97.094 ± 0.005° |
| γ | 90° |
| Cell volume | 2148 ± 0.2 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.1181 |
| Residual factor for significantly intense reflections | 0.0634 |
| Weighted residual factors for significantly intense reflections | 0.1559 |
| Weighted residual factors for all reflections included in the refinement | 0.1991 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
| 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. |
7239325.cif |
| 244653 | 2019-11-28 | cif/ Adding structures of 7239325, 7239326 via cif-deposit CGI script. |
7239325.cif |
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Users of the data should acknowledge the original authors of the
structural data.