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Information card for entry 7233678
Preview
| Coordinates | 7233678.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H36 N2 O2 |
|---|---|
| Calculated formula | C30 H36 N2 O2 |
| Title of publication | Photophysical, electrochemical and solid state properties of diketopyrrolopyrrole based molecular materials: importance of the donor group |
| Authors of publication | Joydeep Dhar; N. Venkatramaiah; Anitha A.; Satish Patil |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2014 |
| Journal volume | 2 |
| Pages of publication | 3457 - 3466 |
| a | 13.489 ± 0.0005 Å |
| b | 5.5404 ± 0.0002 Å |
| c | 17.523 ± 0.0006 Å |
| α | 90° |
| β | 90.06 ± 0.002° |
| γ | 90° |
| Cell volume | 1309.57 ± 0.08 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0804 |
| Residual factor for significantly intense reflections | 0.0455 |
| Weighted residual factors for significantly intense reflections | 0.1237 |
| Weighted residual factors for all reflections included in the refinement | 0.1677 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.775 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 218015 (current) | 2019-09-05 | cif/ Adding structures of 7233678 via cif-deposit CGI script. |
7233678.cif |
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Users of the data should acknowledge the original authors of the
structural data.