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Information card for entry 7236453
Preview
| Coordinates | 7236453.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C36 H38 |
|---|---|
| Calculated formula | C36 H38 |
| Title of publication | Solid state emissive organic fluorophores with remarkable broad color tunability based on aryl-substituted buta-1,3-diene as the central core |
| Authors of publication | Bera, Manas Kumar; Chakraborty, Chanchal; Malik, Sudip |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2017 |
| Journal volume | 5 |
| Journal issue | 27 |
| Pages of publication | 6872 |
| a | 6.038 ± 0.012 Å |
| b | 10.53 ± 0.02 Å |
| c | 11.38 ± 0.02 Å |
| α | 73.66 ± 0.03° |
| β | 86.94 ± 0.03° |
| γ | 87.92 ± 0.03° |
| Cell volume | 693 ± 2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 2 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1483 |
| Residual factor for significantly intense reflections | 0.0688 |
| Weighted residual factors for significantly intense reflections | 0.1626 |
| Weighted residual factors for all reflections included in the refinement | 0.21 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.919 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| 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. |
7236453.cif |
| 235536 | 2019-11-23 | cif/ Adding structures of 7236453 via cif-deposit CGI script. |
7236453.cif |
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Users of the data should acknowledge the original authors of the
structural data.