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Information card for entry 7235294
Preview
| Coordinates | 7235294.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C34 H26 Br N O7 S |
|---|---|
| Calculated formula | C34 H26 Br N O7 S |
| Title of publication | A novel synthesis of tetra and pentacyclic quinolinopyran tethered pyrazole/coumarin scaffolds via a solid state melt reaction |
| Authors of publication | Bakthadoss, Manickam; Kannan, Damodharan |
| Journal of publication | RSC Advances |
| Year of publication | 2014 |
| Journal volume | 4 |
| Journal issue | 23 |
| Pages of publication | 11723 |
| a | 28.633 ± 0.003 Å |
| b | 9.3215 ± 0.0007 Å |
| c | 24.59 ± 0.002 Å |
| α | 90° |
| β | 115.976 ± 0.003° |
| γ | 90° |
| Cell volume | 5900.1 ± 0.9 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0849 |
| Residual factor for significantly intense reflections | 0.0502 |
| Weighted residual factors for significantly intense reflections | 0.1432 |
| Weighted residual factors for all reflections included in the refinement | 0.1746 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7235294.cif |
| 232667 | 2019-11-23 | cif/ Adding structures of 7235294, 7235295 via cif-deposit CGI script. |
7235294.cif |
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Users of the data should acknowledge the original authors of the
structural data.