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Information card for entry 7234422
Preview
| Coordinates | 7234422.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C44 H32 N4 |
|---|---|
| Calculated formula | C44 H32 N4 |
| Title of publication | 4-Diphenylamino-phenyl substituted pyrazine: nonlinear optical switching by protonation |
| Authors of publication | Liang Xu; Hai Zhu; Guankui Long; Jun Zhao; Dongsheng Li; Rakesh Ganguly; Yongxin Li; Qing-Hua Xu; Qichun Zhang |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2015 |
| Journal volume | 3 |
| Pages of publication | 9191 - 9196 |
| a | 10.9996 ± 0.0004 Å |
| b | 15.5466 ± 0.0007 Å |
| c | 20.7794 ± 0.001 Å |
| α | 97.458 ± 0.003° |
| β | 104.211 ± 0.003° |
| γ | 109.487 ± 0.003° |
| Cell volume | 3159 ± 0.3 Å3 |
| Cell temperature | 103 ± 2 K |
| Ambient diffraction temperature | 103 ± 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 | 0.2432 |
| Residual factor for significantly intense reflections | 0.078 |
| Weighted residual factors for significantly intense reflections | 0.1405 |
| Weighted residual factors for all reflections included in the refinement | 0.2041 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.905 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 219131 (current) | 2019-10-07 | cif/ Adding structures of 7234422, 7234423, 7234424 via cif-deposit CGI script. |
7234422.cif |
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Users of the data should acknowledge the original authors of the
structural data.