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Information card for entry 1567861
Preview
| Coordinates | 1567861.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C31 H37 N3 O6 |
|---|---|
| Calculated formula | C31 H37 N3 O6 |
| Title of publication | An atomistic view of rigid crystalline supramolecular polymers derived from short amphiphilic, α,β hybrid peptide |
| Authors of publication | Misra, Rajkumar; Netti, Francesca; Koren, Gil; Dan, Yoav; Chakraborty, Priyadarshi; Cohen, Sidney R.; Shimon, Linda J. W.; Beck, Roy; Adler-Abramovich, Lihi |
| Journal of publication | Polymer Chemistry |
| Year of publication | 2022 |
| Journal volume | 13 |
| Journal issue | 44 |
| Pages of publication | 6223 - 6228 |
| a | 9.2497 ± 0.0006 Å |
| b | 9.6644 ± 0.0002 Å |
| c | 32.938 ± 0.0007 Å |
| α | 90.062 ± 0.002° |
| β | 92.44 ± 0.003° |
| γ | 104.738 ± 0.004° |
| Cell volume | 2844.7 ± 0.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 1 |
| Hermann-Mauguin space group symbol | P 1 |
| Hall space group symbol | P 1 |
| Residual factor for all reflections | 0.1422 |
| Residual factor for significantly intense reflections | 0.1174 |
| Weighted residual factors for significantly intense reflections | 0.3321 |
| Weighted residual factors for all reflections included in the refinement | 0.3486 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.406 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 280222 (current) | 2023-01-06 | cif/ Updating files of 1567861 Original log message: Adding full bibliography for 1567861.cif. |
1567861.cif |
| 278791 | 2022-10-26 | cif/ Adding structures of 1567861 via cif-deposit CGI script. |
1567861.cif |
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