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Information card for entry 7056209
Preview
| Coordinates | 7056209.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H19 I4 N2 O4 |
|---|---|
| Calculated formula | C16 H19 I4 N2 O4 |
| Title of publication | N-(4-hydroxyphenyl)acetamide against di-iodine towards polyiodide dianion |
| Authors of publication | Hadjikakou, Sotiris K.; Banti, C. N.; Kourkoumelis, Nikolaos; Raptopoulou, Catherine; Psycharis, Vassilis |
| Journal of publication | New J. Chem. |
| Year of publication | 2017 |
| a | 14.1757 ± 0.0006 Å |
| b | 9.6136 ± 0.0003 Å |
| c | 17.0845 ± 0.0006 Å |
| α | 90° |
| β | 97.777 ± 0.002° |
| γ | 90° |
| Cell volume | 2306.85 ± 0.15 Å3 |
| Cell temperature | 160 ± 2 K |
| Ambient diffraction temperature | 160 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/n 1 |
| Hall space group symbol | -P 2yac |
| Residual factor for all reflections | 0.0264 |
| Residual factor for significantly intense reflections | 0.0234 |
| Weighted residual factors for significantly intense reflections | 0.0543 |
| Weighted residual factors for all reflections included in the refinement | 0.0557 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 196895 (current) | 2017-05-23 | cif/ Adding structures of 7056209 via cif-deposit CGI script. |
7056209.cif |
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Users of the data should acknowledge the original authors of the
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