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Information card for entry 7248440
Preview
| Coordinates | 7248440.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | (H2dobpdc)(GuaH)2 |
|---|---|
| Formula | C16 H20 N6 O6 |
| Calculated formula | C16 H20 N6 O6 |
| Title of publication | A highly stable hydrogen-bonded organic framework for hydrogen storage |
| Authors of publication | Song, Jeong Hwa; Jeon, Byeong Hak; Kang, Dong Won |
| Journal of publication | CrystEngComm |
| Year of publication | 2024 |
| Journal volume | 26 |
| Journal issue | 18 |
| Pages of publication | 2342 - 2345 |
| a | 4.804 ± 0.001 Å |
| b | 18.247 ± 0.004 Å |
| c | 9.818 ± 0.002 Å |
| α | 90° |
| β | 104 ± 0.03° |
| γ | 90° |
| Cell volume | 835.1 ± 0.3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0818 |
| Residual factor for significantly intense reflections | 0.0806 |
| Weighted residual factors for significantly intense reflections | 0.2449 |
| Weighted residual factors for all reflections included in the refinement | 0.2481 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.142 |
| Diffraction radiation wavelength | 0.7 Å |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 292977 (current) | 2024-07-05 | cif/ Updating files of 7248440 Original log message: Adding full bibliography for 7248440.cif. |
7248440.cif |
| 291275 | 2024-04-19 | cif/ Adding structures of 7248440 via cif-deposit CGI script. |
7248440.cif |
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