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Information card for entry 7134810
Preview
| Coordinates | 7134810.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | DM12 |
|---|---|
| Formula | C24 H17 Br N2 O2 |
| Calculated formula | C24 H17 Br N2 O2 |
| Title of publication | Water-Driven Modulation of Multiresponsive Properties in Acylhydrazone-based Crystals |
| Authors of publication | Manoharan, Deepak; Bhowmik, Aritra; Mishra, Manish Kumar; Ghosh, Soumyajit |
| Journal of publication | Chemical Communications |
| Year of publication | 2025 |
| a | 4.6907 ± 0.0005 Å |
| b | 12.763 ± 0.0017 Å |
| c | 31.449 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1882.8 ± 0.4 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0842 |
| Residual factor for significantly intense reflections | 0.0483 |
| Weighted residual factors for significantly intense reflections | 0.0898 |
| Weighted residual factors for all reflections included in the refinement | 0.1035 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.005 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300350 (current) | 2025-07-05 | cif/ Adding structures of 7134810, 7134811, 7134812 via cif-deposit CGI script. |
7134810.cif |
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Users of the data should acknowledge the original authors of the
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