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Information card for entry 2242775
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| Coordinates | 2242775.cif |
|---|---|
| Structure factors | 2242775.hkl |
| Original paper (by DOI) | HTML |
| Chemical name | <i>N</i>-<i>tert</i>-Butyl-2-[4-(dimethylamino)phenyl]imidazo[1,2-<i>a</i>]pyridin-3-amine |
|---|---|
| Formula | C19 H24 N4 |
| Calculated formula | C19 H24 N4 |
| SMILES | N(c1n2ccccc2nc1c1ccc(N(C)C)cc1)C(C)(C)C |
| Title of publication | Crystal structure and Hirshfeld surface analysis of two imidazo[1,2-<i>a</i>]pyridine derivatives: <i>N</i>-<i>tert</i>-butyl-2-(4-methoxyphenyl)-5-methylimidazo[1,2-<i>a</i>]pyridin-3-amine and <i>N</i>-<i>tert</i>-butyl-2-[4-(dimethylamino)phenyl]imidazo[1,2-<i>a</i>]pyridin-3-amine |
| Authors of publication | Dhanalakshmi, G.; Ramanjaneyulu, Mala; Thennarasu, Sathiah; Aravindhan, S. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2018 |
| Journal volume | 74 |
| Journal issue | 12 |
| Pages of publication | 1913 - 1918 |
| a | 34.9185 ± 0.0014 Å |
| b | 8.4656 ± 0.0005 Å |
| c | 11.8361 ± 0.0006 Å |
| α | 90° |
| β | 91.061 ± 0.005° |
| γ | 90° |
| Cell volume | 3498.2 ± 0.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.11 |
| Residual factor for significantly intense reflections | 0.0492 |
| Weighted residual factors for significantly intense reflections | 0.119 |
| Weighted residual factors for all reflections included in the refinement | 0.1593 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 212319 (current) | 2018-12-04 | cif/ hkl/ Adding structures of 2242774, 2242775 via cif-deposit CGI script. |
2242775.cif 2242775.hkl |
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