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Information card for entry 7250357
Preview
| Coordinates | 7250357.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H9 Br Cl N O |
|---|---|
| Calculated formula | C13 H9 Br Cl N O |
| Title of publication | Similar Polymorphism of Derivatives of Salicylideneanilines with Varying Halo-substitution. |
| Authors of publication | ZHANG, Zaixiang; Li, Xin; Liu, Junyu; Wang, Manman; Yang, Yang; Wang, De-Yin |
| Journal of publication | CrystEngComm |
| Year of publication | 2025 |
| a | 10.1482 ± 0.0005 Å |
| b | 4.7544 ± 0.0002 Å |
| c | 11.9871 ± 0.0008 Å |
| α | 90° |
| β | 92.605 ± 0.005° |
| γ | 90° |
| Cell volume | 577.76 ± 0.05 Å3 |
| Cell temperature | 113.15 K |
| Ambient diffraction temperature | 113.15 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 | 0.0555 |
| Residual factor for significantly intense reflections | 0.0537 |
| Weighted residual factors for significantly intense reflections | 0.1259 |
| Weighted residual factors for all reflections included in the refinement | 0.1266 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.391 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299562 (current) | 2025-05-08 | cif/ Adding structures of 7250356, 7250357, 7250358 via cif-deposit CGI script. |
7250357.cif |
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