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Information card for entry 7250900
Preview
| Coordinates | 7250900.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H12 N2 O4 |
|---|---|
| Calculated formula | C13 H12 N2 O4 |
| Title of publication | Are supramolecular synthons stable as discrete units? Results from a series of salts of 4-(4-hydroxyphenylazo)benzoic acid and its derivatives with aminopyridines |
| Authors of publication | Singh, Munendra Pal; Hazarika, Abhinav; Baruah, Jubaraj B. |
| Journal of publication | Physical Chemistry Chemical Physics |
| Year of publication | 2025 |
| a | 6.193 ± 0.0011 Å |
| b | 8.8783 ± 0.0016 Å |
| c | 11.8108 ± 0.0018 Å |
| α | 104.567 ± 0.014° |
| β | 94.949 ± 0.014° |
| γ | 104.436 ± 0.015° |
| Cell volume | 600.94 ± 0.19 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1043 |
| Residual factor for significantly intense reflections | 0.0572 |
| Weighted residual factors for significantly intense reflections | 0.1394 |
| Weighted residual factors for all reflections included in the refinement | 0.1854 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.954 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 302240 (current) | 2025-09-24 | cif/ Adding structures of 7250900, 7250901 via cif-deposit CGI script. |
7250900.cif |
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Users of the data should acknowledge the original authors of the
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