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Information card for entry 7112329
Preview
| Coordinates | 7112329.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | foldamers |
|---|---|
| Formula | C17 H27 N3 O5 S |
| Calculated formula | C17 H20 N3 O5 S |
| Title of publication | Orthanilic acid-promoted reverse turn formation in peptides. |
| Authors of publication | Kale, Sangram S.; Priya, Gowri; Kotmale, Amol S.; Gawade, Rupesh L.; Puranik, Vedavati G.; Rajamohanan, P. R.; Sanjayan, Gangadhar J. |
| Journal of publication | Chemical communications (Cambridge, England) |
| Year of publication | 2013 |
| Journal volume | 49 |
| Journal issue | 22 |
| Pages of publication | 2222 - 2224 |
| a | 29.295 ± 0.0003 Å |
| b | 46.538 ± 0.0005 Å |
| c | 5.7943 ± 0.0001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 7899.55 ± 0.18 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 43 |
| Hermann-Mauguin space group symbol | F d d 2 |
| Hall space group symbol | F 2 -2d |
| Residual factor for all reflections | 0.0856 |
| Residual factor for significantly intense reflections | 0.0748 |
| Weighted residual factors for significantly intense reflections | 0.1906 |
| Weighted residual factors for all reflections included in the refinement | 0.1972 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.157 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Duplicate of | 7108933 |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.