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Information card for entry 4518794
Preview
| Coordinates | 4518794.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H12 N4 O2 |
|---|---|
| Calculated formula | C16 H12 N4 O2 |
| 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 | 7.8674 ± 0.0012 Å |
| b | 10.8182 ± 0.0015 Å |
| c | 16.305 ± 0.003 Å |
| α | 94.407 ± 0.007° |
| β | 91.928 ± 0.007° |
| γ | 97.087 ± 0.007° |
| Cell volume | 1371.8 ± 0.4 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 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 significantly intense reflections | 0.083 |
| Weighted residual factors for all reflections included in the refinement | 0.288 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| 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. |
4518794.cif |
| 266315 | 2021-06-10 | cif/ Adding structures of 4518794 via cif-deposit CGI script. |
4518794.cif |
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Users of the data should acknowledge the original authors of the
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