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Information card for entry 2312347
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| Coordinates | 2312347.cif |
|---|---|
| Structure factors | 2312347.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>N</i>-Triphenylacetyl-<i>L</i>-tyrosine chloroform monosolvate |
|---|---|
| Formula | C30 H26 Cl3 N O4 |
| Calculated formula | C30 H26 Cl3 N O4 |
| Title of publication | Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents. |
| Authors of publication | Czapik, Agnieszka; Kwit, Marcin |
| Journal of publication | Acta crystallographica. Section C, Structural chemistry |
| Year of publication | 2021 |
| Journal volume | 77 |
| Journal issue | Pt 12 |
| Pages of publication | 745 - 756 |
| a | 10.0732 ± 0.0003 Å |
| b | 10.0051 ± 0.0002 Å |
| c | 14.7474 ± 0.0004 Å |
| α | 90° |
| β | 109.945 ± 0.003° |
| γ | 90° |
| Cell volume | 1397.15 ± 0.07 Å3 |
| Cell temperature | 130 ± 2 K |
| Ambient diffraction temperature | 130 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0487 |
| Residual factor for significantly intense reflections | 0.0483 |
| Weighted residual factors for significantly intense reflections | 0.1287 |
| Weighted residual factors for all reflections included in the refinement | 0.1293 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287487 (current) | 2023-11-08 | cif/ hkl/ Adding structures of 2312347, 2312348, 2312349, 2312350, 2312351 via cif-deposit CGI script. |
2312347.cif 2312347.hkl |
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Users of the data should acknowledge the original authors of the
structural data.