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Information card for entry 4517869
Preview
| Coordinates | 4517869.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H34 N2 O2 |
|---|---|
| Calculated formula | C21 H34 N2 O2 |
| Title of publication | Amino Acid-Containing Phase-Selective Organogelators: A Water-Based Delivery System for Oil Spill Treatment |
| Authors of publication | Chen, Jun; Boott, Charlotte E.; Lewis, Lev; Siu, Andrew; Al-Debasi, Renad; Carta, Veronica; Fogh, Amanda A.; Kurek, Daniel Z.; Wang, Lilo; MacLachlan, Mark J.; Hum, Gabriel |
| Journal of publication | ACS Omega |
| Year of publication | 2020 |
| a | 8.697 ± 0.005 Å |
| b | 4.949 ± 0.003 Å |
| c | 23.171 ± 0.012 Å |
| α | 90° |
| β | 94.349 ± 0.014° |
| γ | 90° |
| Cell volume | 994.4 ± 1 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 4 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0467 |
| Residual factor for significantly intense reflections | 0.0363 |
| Weighted residual factors for all reflections | 0.0918 |
| Weighted residual factors for significantly intense reflections | 0.0841 |
| Weighted residual factors for all reflections included in the refinement | 0.0918 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.9748 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 254514 (current) | 2020-07-24 | cif/ Adding structures of 4517869 via cif-deposit CGI script. |
4517869.cif |
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Users of the data should acknowledge the original authors of the
structural data.