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Information card for entry 7129522
Preview
| Coordinates | 7129522.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C4 H12 Cl3 Mn N O |
|---|---|
| Calculated formula | C4 H12 Cl3 Mn N O |
| Title of publication | Two-step nonlinear optical switch in a hydrogen-bonded perovskite-type crystal |
| Authors of publication | Hua, Xiu-Ni; Zhang, Wan-Ying; Shi, Ping-Ping |
| Journal of publication | Chemical Communications |
| Year of publication | 2022 |
| a | 9.9332 ± 0.0009 Å |
| b | 14.5412 ± 0.0011 Å |
| c | 6.5977 ± 0.0006 Å |
| α | 90° |
| β | 95.019 ± 0.008° |
| γ | 90° |
| Cell volume | 949.32 ± 0.14 Å3 |
| Cell temperature | 223 ± 2 K |
| Ambient diffraction temperature | 223 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0524 |
| Residual factor for significantly intense reflections | 0.0496 |
| Weighted residual factors for significantly intense reflections | 0.1383 |
| Weighted residual factors for all reflections included in the refinement | 0.1395 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.277 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 271945 (current) | 2022-01-08 | cif/ Adding structures of 7129521, 7129522, 7129523 via cif-deposit CGI script. |
7129522.cif |
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