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Information card for entry 4003664
Preview
| Coordinates | 4003664.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Fmoc-pentafluoro-L-phenylalanine |
|---|---|
| Chemical name | (S)-2-(Fmoc-amino)-3-(pentafluorophenyl)propionic acid |
| Formula | C48 H32 F10 N2 O8 |
| Calculated formula | C48 H32 F10 N2 O8 |
| Title of publication | Phase Transition and Crystallization Kinetics of a Supramolecular System in a Microfluidic Platform |
| Authors of publication | Cohen-Gerassi, Dana; Arnon, Zohar A.; Guterman, Tom; Levin, Aviad; Ghosh, Moumita; Aviv, Moran; Levy, Davide; Knowles, Tuomas P. J.; Shacham-Diamand, Yosi; Adler-Abramovich, Lihi |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2020 |
| a | 28.104 ± 0.007 Å |
| b | 4.9819 ± 0.0015 Å |
| c | 15.811 ± 0.006 Å |
| α | 90° |
| β | 92.016 ± 0.027° |
| γ | 90° |
| Cell volume | 2212.3 ± 1.2 Å3 |
| Cell temperature | 300 K |
| Ambient diffraction temperature | 300 K |
| Ambient diffracton pressure | 100 kPa |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Weighted residual factors for significantly intense reflections | 0.09958 |
| RFsqd | 0.29649 |
| Goodness-of-fit parameter for all reflections | 31.967 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.5405 Å |
| Diffraction radiation type | CuKα~1,2~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 255409 (current) | 2020-08-18 | cif/ Adding structures of 4003664 via cif-deposit CGI script. |
4003664.cif |
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Users of the data should acknowledge the original authors of the
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