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Information card for entry 7236486
Preview
| Coordinates | 7236486.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C31 H25 Br |
|---|---|
| Calculated formula | C31 H25 Br |
| Title of publication | Easy access to new anthracenyl π-conjugates: generation of distinct AIE-active materials |
| Authors of publication | Zubair Khalid Baig, M.; Majhi, Debashis; Tulichala, R. N. Prasad; Sarkar, Moloy; Chakravarty, Manab |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2017 |
| Journal volume | 5 |
| Journal issue | 9 |
| Pages of publication | 2380 |
| a | 9.6879 ± 0.0006 Å |
| b | 10.8287 ± 0.0008 Å |
| c | 12.5904 ± 0.0008 Å |
| α | 109.624 ± 0.007° |
| β | 101.816 ± 0.006° |
| γ | 94.794 ± 0.006° |
| Cell volume | 1201.01 ± 0.16 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.096 |
| Residual factor for significantly intense reflections | 0.0823 |
| Weighted residual factors for significantly intense reflections | 0.2263 |
| Weighted residual factors for all reflections included in the refinement | 0.2415 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.082 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| 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. |
7236486.cif |
| 235578 | 2019-11-23 | cif/ Adding structures of 7236486, 7236487 via cif-deposit CGI script. |
7236486.cif |
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Users of the data should acknowledge the original authors of the
structural data.