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Information card for entry 7249640
Preview
| Coordinates | 7249640.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H18 F3 N5 O3 |
|---|---|
| Calculated formula | C25 H18 F3 N5 O3 |
| Title of publication | Exploring Novel Cocrystals of Milrinone: A Cardioprotective Drug Combined with Nutraceuticals and NSAID |
| Authors of publication | Kenguva, Gowtham; Rekha Rout, Smruti; Shaikh, Tabrez R.; Baidya, Debjani; Shelke, Nikita; Sanphui, Palash; Dandela, Rambabu |
| Journal of publication | CrystEngComm |
| Year of publication | 2024 |
| a | 10.7282 ± 0.0009 Å |
| b | 10.7734 ± 0.0009 Å |
| c | 11.9845 ± 0.0011 Å |
| α | 85.55 ± 0.002° |
| β | 65.237 ± 0.002° |
| γ | 64.849 ± 0.002° |
| Cell volume | 1130.01 ± 0.17 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298.15 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 | 0.0718 |
| Residual factor for significantly intense reflections | 0.0502 |
| Weighted residual factors for significantly intense reflections | 0.1207 |
| Weighted residual factors for all reflections included in the refinement | 0.1397 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.071 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 296127 (current) | 2024-11-27 | cif/ Adding structures of 7249640, 7249641, 7249642 via cif-deposit CGI script. |
7249640.cif |
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Users of the data should acknowledge the original authors of the
structural data.