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Information card for entry 7227372
Preview
| Coordinates | 7227372.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | Glibenclamide-ammonium salt |
|---|---|
| Chemical name | 5-chloro-N-(4-[N-(cyclohexylcarbamoyl)sulfamoyl]phenethyl)-2-methoxybenzamide-ammonium |
| Formula | C23 H31 Cl N4 O5 S |
| Calculated formula | C23 H31 Cl N4 O5 S |
| SMILES | S(=O)([O-])(=NC(=O)NC1CCCCC1)c1ccc(cc1)CCNC(=O)c1c(OC)ccc(Cl)c1.[NH4+] |
| Title of publication | Polymorphism, isostructurality and physicochemical properties of glibenclamide salts |
| Authors of publication | Suresh, Kuthuru; Khandavilli, U. B. Rao; Gunnam, Anilkumar; Nangia, Ashwini |
| Journal of publication | CrystEngComm |
| Year of publication | 2017 |
| Journal volume | 19 |
| Journal issue | 6 |
| Pages of publication | 918 |
| a | 19.718 ± 0.004 Å |
| b | 6.1475 ± 0.0011 Å |
| c | 21.732 ± 0.005 Å |
| α | 90° |
| β | 109.25 ± 0.02° |
| γ | 90° |
| Cell volume | 2487 ± 0.9 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.2463 |
| Residual factor for significantly intense reflections | 0.0644 |
| Weighted residual factors for significantly intense reflections | 0.0682 |
| Weighted residual factors for all reflections included in the refinement | 0.0919 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.77 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301865 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/22/ Each referenced PubChem compound corresponds to the full crystal structure. |
7227372.cif |
| 193758 | 2017-03-05 | cif/ Updating files of 7227370, 7227371, 7227372, 7227373, 7227374, 7227375 Original log message: Adding full bibliography for 7227370--7227375.cif. |
7227372.cif |
| 190005 | 2017-01-07 | cif/ Adding structures of 7227370, 7227371, 7227372, 7227373, 7227374, 7227375 via cif-deposit CGI script. |
7227372.cif |
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Users of the data should acknowledge the original authors of the
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