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Information card for entry 7234923
Preview
| Coordinates | 7234923.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C6 H16 Br5 N2 Sb |
|---|---|
| Calculated formula | C6 H16 Br5 N2 Sb |
| Title of publication | Near-room-temperature tunable dielectric response induced by dual phase transitions in a lead-free hybrid: (C3H8N)2SbBr5 |
| Authors of publication | Li, Maofan; Teng, Bing; Han, Shiguo; Yang, Tao; Li, Yaobin; Liu, Yi; Zhang, Xinyuan; Liu, Xitao; Luo, Junhua; Sun, Zhihua |
| Journal of publication | CrystEngComm |
| Year of publication | 2019 |
| Journal volume | 21 |
| Journal issue | 24 |
| Pages of publication | 3740 |
| a | 11.894 ± 0.002 Å |
| b | 19.099 ± 0.004 Å |
| c | 7.8047 ± 0.0016 Å |
| α | 90° |
| β | 108.91 ± 0.03° |
| γ | 90° |
| Cell volume | 1677.3 ± 0.6 Å3 |
| Cell temperature | 270 ± 2 K |
| Ambient diffraction temperature | 270 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0415 |
| Residual factor for significantly intense reflections | 0.0313 |
| Weighted residual factors for significantly intense reflections | 0.0643 |
| Weighted residual factors for all reflections included in the refinement | 0.0691 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 223242 (current) | 2019-11-05 | cif/ Adding structures of 7234922, 7234923, 7234924 via cif-deposit CGI script. |
7234923.cif |
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Users of the data should acknowledge the original authors of the
structural data.