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Information card for entry 1571737
Preview
| Coordinates | 1571737.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H34 Br4 N2 O4 |
|---|---|
| Calculated formula | C30 H34 Br4 N2 O4 |
| Title of publication | Engineered solid-state aggregates in brickwork stacks of n-type organic semiconductors: a way to achieve high electron mobility. |
| Authors of publication | Giri, Indrajit; Chhetri, Shant; John P, Jesslyn; Mondal, Madalasa; Dey, Arka Bikash; Vijayaraghavan, Ratheesh K. |
| Journal of publication | Chemical science |
| Year of publication | 2024 |
| Journal volume | 15 |
| Journal issue | 25 |
| Pages of publication | 9630 - 9640 |
| a | 5.2191 ± 0.0003 Å |
| b | 9.7042 ± 0.0004 Å |
| c | 14.6193 ± 0.0006 Å |
| α | 92.556 ± 0.003° |
| β | 99.112 ± 0.004° |
| γ | 90.114 ± 0.004° |
| Cell volume | 730.32 ± 0.06 Å3 |
| Cell temperature | 99.97 ± 0.15 K |
| Ambient diffraction temperature | 99.97 ± 0.15 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 | 0.1043 |
| Residual factor for significantly intense reflections | 0.0953 |
| Weighted residual factors for significantly intense reflections | 0.2924 |
| Weighted residual factors for all reflections included in the refinement | 0.3137 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.454 |
| 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 |
|---|---|---|---|
| 292892 (current) | 2024-07-05 | cif/ Updating files of 1571735, 1571736, 1571737 Original log message: Adding full bibliography for 1571735--1571737.cif. |
1571737.cif |
| 292132 | 2024-06-01 | cif/ Adding structures of 1571735, 1571736, 1571737 via cif-deposit CGI script. |
1571737.cif |
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CC0
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.
Users of the data should acknowledge the original authors of the
structural data.