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Information card for entry 7249438
Preview
| Coordinates | 7249438.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H21 N3 O4 S |
|---|---|
| Calculated formula | C12.5 H10.5 N1.5 O2 S0.5 |
| Title of publication | Novel A-π-D-A organic dyes for better photovoltaic performance. |
| Authors of publication | Roys, Krupa Elsa; Manju, S. L.; Siddiq, Mohamed; Sambandam, Anandan |
| Journal of publication | RSC advances |
| Year of publication | 2024 |
| Journal volume | 14 |
| Journal issue | 40 |
| Pages of publication | 29229 - 29241 |
| a | 10.4665 ± 0.0007 Å |
| b | 10.8561 ± 0.0008 Å |
| c | 16.2199 ± 0.0011 Å |
| α | 86.643 ± 0.003° |
| β | 76.578 ± 0.002° |
| γ | 61.751 ± 0.002° |
| Cell volume | 1576.31 ± 0.19 Å3 |
| Cell temperature | 300 K |
| Ambient diffraction temperature | 300 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1416 |
| Residual factor for significantly intense reflections | 0.0906 |
| Weighted residual factors for significantly intense reflections | 0.3076 |
| Weighted residual factors for all reflections included in the refinement | 0.375 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.2725 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 295081 (current) | 2024-10-06 | cif/ Adding structures of 7249438 via cif-deposit CGI script. |
7249438.cif |
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Users of the data should acknowledge the original authors of the
structural data.