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Information card for entry 7241414
Preview
| Coordinates | 7241414.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Boc-Phe-Aib-OMe |
|---|---|
| Formula | C19 H28 N2 O5 |
| Calculated formula | C19 H28 N2 O5 |
| Title of publication | A new dipeptide as selective gelator of Cu(II), Zn(II), Pb(II) |
| Authors of publication | Kumar, Santosh; Nandi, Sujay; Suman, Saurav; Haldar, Debasish |
| Journal of publication | CrystEngComm |
| Year of publication | 2020 |
| a | 8.279 ± 0.017 Å |
| b | 11.9 ± 0.03 Å |
| c | 20.37 ± 0.04 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2007 ± 8 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273.15 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0873 |
| Residual factor for significantly intense reflections | 0.0586 |
| Weighted residual factors for significantly intense reflections | 0.1296 |
| Weighted residual factors for all reflections included in the refinement | 0.146 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.96 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 258484 (current) | 2020-10-20 | cif/ Adding structures of 7241414, 7241415, 7241416 via cif-deposit CGI script. |
7241414.cif |
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