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Information card for entry 7129351
Preview
| Coordinates | 7129351.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C2 H4 N4 |
|---|---|
| Calculated formula | C2 H4 N4 |
| SMILES | N#CN=C(N)N |
| Title of publication | Robust and color-tunable afterglows from guanidine derivatives |
| Authors of publication | Zhao, Zihao; Li, Yuxuan; Chen, Xiaohong; Zhang, Yongming; Yuan, Wang Zhang |
| Journal of publication | Chemical Communications |
| Year of publication | 2021 |
| a | 14.9827 ± 0.0005 Å |
| b | 4.4969 ± 0.0001 Å |
| c | 13.1144 ± 0.0004 Å |
| α | 90° |
| β | 115.361 ± 0.001° |
| γ | 90° |
| Cell volume | 798.44 ± 0.04 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 | 0.0346 |
| Residual factor for significantly intense reflections | 0.0329 |
| Weighted residual factors for significantly intense reflections | 0.096 |
| Weighted residual factors for all reflections included in the refinement | 0.0973 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.096 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 271251 (current) | 2021-12-08 | cif/ Adding structures of 7129351, 7129352 via cif-deposit CGI script. |
7129351.cif |
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