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Information card for entry 7246194
Preview
| Coordinates | 7246194.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H18 O2 S |
|---|---|
| Calculated formula | C27 H18 O2 S |
| Title of publication | Flanking-donor-controlled diversity in mechanical-force-induced reversible fluorochromism and enhanced emission for carboxylic acid and ester linked solid-state emitters |
| Authors of publication | Chakraborty, Madhuparna; Chakravarty, Manab |
| Journal of publication | CrystEngComm |
| Year of publication | 2023 |
| Journal volume | 25 |
| Journal issue | 7 |
| Pages of publication | 1126 - 1135 |
| a | 9.2745 ± 0.0002 Å |
| b | 9.8947 ± 0.0002 Å |
| c | 13.565 ± 0.0002 Å |
| α | 83.663 ± 0.001° |
| β | 81.113 ± 0.002° |
| γ | 72.576 ± 0.002° |
| Cell volume | 1170.74 ± 0.04 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 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 | 0.0426 |
| Residual factor for significantly intense reflections | 0.0402 |
| Weighted residual factors for significantly intense reflections | 0.1227 |
| Weighted residual factors for all reflections included in the refinement | 0.1249 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.093 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 281451 (current) | 2023-03-04 | cif/ Updating files of 7246194, 7246195, 7246196, 7246197 Original log message: Adding full bibliography for 7246194--7246197.cif. |
7246194.cif |
| 280561 | 2023-01-25 | cif/ Adding structures of 7246194, 7246195, 7246196, 7246197 via cif-deposit CGI script. |
7246194.cif |
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Users of the data should acknowledge the original authors of the
structural data.