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Information card for entry 4518797
Preview
| Coordinates | 4518797.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Hamada_GH64C_27_09_17 |
|---|---|
| Formula | C20 H10 Br N5 |
| Calculated formula | C20 H10 Br N5 |
| Title of publication | TFA-catalyzed Q-Tube Reactor-Assisted Strategy for the Synthesis of Pyrido[1,2-<i>b</i>][1,2,4]triazine and Pyrido[1',2':2,3][1,2,4]triazino[5,6-<i>b</i>]indole Derivatives. |
| Authors of publication | Ibrahim, Hamada Mohamed; Behbehani, Haider |
| Journal of publication | ACS omega |
| Year of publication | 2021 |
| Journal volume | 6 |
| Journal issue | 24 |
| Pages of publication | 16086 - 16099 |
| a | 16.8422 ± 0.0008 Å |
| b | 14.1742 ± 0.0008 Å |
| c | 7.0948 ± 0.0004 Å |
| α | 90° |
| β | 90.995 ± 0.004° |
| γ | 90° |
| Cell volume | 1693.45 ± 0.16 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/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0727 |
| Residual factor for significantly intense reflections | 0.0551 |
| Weighted residual factors for significantly intense reflections | 0.1585 |
| Weighted residual factors for all reflections included in the refinement | 0.1819 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 266964 (current) | 2021-07-04 | cif/ Updating files of 4518794, 4518795, 4518796, 4518797, 4518798, 4518799, 4518800 Original log message: Adding full bibliography for 4518794--4518800.cif. |
4518797.cif |
| 266318 | 2021-06-10 | cif/ Adding structures of 4518797 via cif-deposit CGI script. |
4518797.cif |
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Users of the data should acknowledge the original authors of the
structural data.