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Information card for entry 7241532
Preview
| Coordinates | 7241532.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Nicorandil-Subaric acid cocrystal |
|---|---|
| Formula | C12 H16 N3 O6 |
| Calculated formula | C12 H16 N3 O6 |
| Title of publication | Enhanced solubility, permeability, and tabletability of nicorandil by salt and cocrystal formation |
| Authors of publication | Mannava, M. K. Chaitanya; Gunnam, Anilkumar; Lodagekar, Anurag; Shastri, Nalini R.; Nangia, Ashwini K.; Solomon, K. Anand |
| Journal of publication | CrystEngComm |
| Year of publication | 2021 |
| Journal volume | 23 |
| Journal issue | 1 |
| Pages of publication | 227 - 237 |
| a | 6.835 ± 0.002 Å |
| b | 23.752 ± 0.005 Å |
| c | 8.939 ± 0.002 Å |
| α | 90° |
| β | 101.16 ± 0.03° |
| γ | 90° |
| Cell volume | 1423.8 ± 0.6 Å3 |
| Cell temperature | 298 K |
| Ambient diffraction temperature | 298 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1291 |
| Residual factor for significantly intense reflections | 0.0606 |
| Weighted residual factors for significantly intense reflections | 0.1345 |
| Weighted residual factors for all reflections included in the refinement | 0.1635 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
| Diffraction radiation wavelength | 0.71076 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 261590 (current) | 2021-02-05 | cif/ Updating files of 7241531, 7241532 Original log message: Adding full bibliography for 7241531--7241532.cif. |
7241532.cif |
| 259307 | 2020-11-29 | cif/ Adding structures of 7241531, 7241532 via cif-deposit CGI script. |
7241532.cif |
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Users of the data should acknowledge the original authors of the
structural data.