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Information card for entry 2108436
Preview
| Coordinates | 2108436.cif |
|---|---|
| Structure factors | 2108436.hkl |
| Original paper (by DOI) | HTML |
| Formula | C6 H9.67 N11 |
|---|---|
| Calculated formula | C6 H9.6667 N11 |
| Title of publication | Accessing the rich carbon nitride materials chemistry by heat treatments of ammonium thiocyanate, NH~4~SCN |
| Authors of publication | Larsen, Finn Krebs; Hasen Mamakhel, Aref; Overgaard, Jacob; Jørgensen, Jens-Erik; Kato, Kenichi; Brummerstedt Iversen, Bo |
| Journal of publication | Acta Crystallographica Section B |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 4 |
| a | 3.534 ± 0.003 Å |
| b | 28.13 ± 0.02 Å |
| c | 10.698 ± 0.005 Å |
| α | 90° |
| β | 97.025 ± 0.013° |
| γ | 90° |
| Cell volume | 1055.5 ± 1.3 Å3 |
| Cell temperature | 100 ± 1 K |
| Ambient diffraction temperature | 100 ± 1 K |
| Number of distinct elements | 3 |
| 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 | 0.0935 |
| Residual factor for significantly intense reflections | 0.0641 |
| Weighted residual factors for significantly intense reflections | 0.1799 |
| Weighted residual factors for all reflections included in the refinement | 0.2139 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.137 |
| Diffraction radiation wavelength | 0.56086 Å |
| Diffraction radiation type | AgKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216135 (current) | 2019-06-20 | cif/ hkl/ Adding structures of 2108434, 2108435, 2108436, 2108437, 2108438 via cif-deposit CGI script. |
2108436.cif 2108436.hkl |
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Users of the data should acknowledge the original authors of the
structural data.