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Information card for entry 2312351
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| Coordinates | 2312351.cif |
|---|---|
| Structure factors | 2312351.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>N</i>-Triphenylacetyl-<i>L</i>-tyrosine chloroform sesquisolvate |
|---|---|
| Formula | C30.5 H26.5 Cl4.5 N O4 |
| Calculated formula | C30.5 H26.5 Cl4.5 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 | 10.00099 ± 0.00016 Å |
| b | 9.33129 ± 0.00013 Å |
| c | 31.8959 ± 0.0005 Å |
| α | 90° |
| β | 90.4958 ± 0.0013° |
| γ | 90° |
| Cell volume | 2976.48 ± 0.08 Å3 |
| Cell temperature | 130 ± 2 K |
| Ambient diffraction temperature | 130 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0747 |
| Residual factor for significantly intense reflections | 0.0577 |
| Weighted residual factors for significantly intense reflections | 0.1467 |
| Weighted residual factors for all reflections included in the refinement | 0.1584 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| 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. |
2312351.cif 2312351.hkl |
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Users of the data should acknowledge the original authors of the
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