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Information card for entry 7221142
Preview
| Coordinates | 7221142.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C23 H18 Br N5 |
|---|---|
| Calculated formula | C23 H18 Br N5 |
| SMILES | Brc1ccc(cc1)Cn1nnc(c1)c1nc2n(c1Cc1ccccc1)cccc2 |
| Title of publication | Synthesis of 2-triazolyl-imidazo[1,2-a]pyridine through one-pot three-component reaction using nano copper oxide assisted click-catalyst |
| Authors of publication | Khan, Abu Taleb; Ray Bagdi, Prasanta; Basha R, Sidick |
| Journal of publication | RSC Adv. |
| Year of publication | 2015 |
| a | 10.5296 ± 0.0011 Å |
| b | 17.3251 ± 0.0018 Å |
| c | 22.405 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4087.3 ± 0.7 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.1445 |
| Residual factor for significantly intense reflections | 0.0503 |
| Weighted residual factors for significantly intense reflections | 0.1389 |
| Weighted residual factors for all reflections included in the refinement | 0.1813 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.93 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 141472 (current) | 2015-07-09 | cif/ Adding structures of 7221141, 7221142 via cif-deposit CGI script. |
7221142.cif |
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Users of the data should acknowledge the original authors of the
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