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Information card for entry 7123236
Preview
| Coordinates | 7123236.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 18071z |
|---|---|
| Formula | C18 H21 Cl N4 O4 |
| Calculated formula | C18 H21 Cl N4 O4 |
| Title of publication | Supramolecular Synthon Approach to Design Amorphous Solid Dispersions with Exceptional Physical Stability |
| Authors of publication | Suryanarayanan, Raj; Duggirala, Naga Kiran; Li, Jinghan; N S, Krishna Kumar; Gopinath, Tata |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 6.6312 ± 0.0004 Å |
| b | 12.1271 ± 0.0007 Å |
| c | 12.3925 ± 0.0007 Å |
| α | 97.657 ± 0.002° |
| β | 95.471 ± 0.002° |
| γ | 102.874 ± 0.002° |
| Cell volume | 954.76 ± 0.1 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0528 |
| Residual factor for significantly intense reflections | 0.0415 |
| Weighted residual factors for significantly intense reflections | 0.101 |
| Weighted residual factors for all reflections included in the refinement | 0.1108 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.008 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 214429 (current) | 2019-03-31 | cif/ Adding structures of 7123236 via cif-deposit CGI script. |
7123236.cif |
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Users of the data should acknowledge the original authors of the
structural data.