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Information card for entry 7243259
Preview
| Coordinates | 7243259.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | DL-Asn.H2O2 |
|---|---|
| Formula | C4 H10 N2 O5 |
| Calculated formula | C4 H10 N2 O5 |
| Title of publication | Efficient capturing of hydrogen peroxide in dilute aqueous solution by co-crystallization with amino acids |
| Authors of publication | Yamaguchi, Ryota; Tanaka, Rika; Maetani, Mayu; Tabe, Hiroyasu; Yamada, Yusuke |
| Journal of publication | CrystEngComm |
| Year of publication | 2021 |
| Journal volume | 23 |
| Journal issue | 32 |
| Pages of publication | 5456 - 5462 |
| a | 4.7744 ± 0.0004 Å |
| b | 7.3961 ± 0.0007 Å |
| c | 9.8715 ± 0.0006 Å |
| α | 90.222 ± 0.005° |
| β | 90.124 ± 0.003° |
| γ | 101.127 ± 0.006° |
| Cell volume | 342.03 ± 0.05 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 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 all reflections | 0.043 |
| Residual factor for significantly intense reflections | 0.0371 |
| Weighted residual factors for significantly intense reflections | 0.0865 |
| Weighted residual factors for all reflections included in the refinement | 0.0919 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 268648 (current) | 2021-09-06 | cif/ Updating files of 7243257, 7243258, 7243259, 7243260 Original log message: Adding full bibliography for 7243257--7243260.cif. |
7243259.cif |
| 267712 | 2021-07-23 | cif/ Adding structures of 7243257, 7243258, 7243259, 7243260 via cif-deposit CGI script. |
7243259.cif |
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Users of the data should acknowledge the original authors of the
structural data.