Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7036480
Preview
| Coordinates | 7036480.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C31 H24 Au F5 N2 O |
|---|---|
| Calculated formula | C31 H24 Au F5 N2 O |
| SMILES | [Au](C#[N]c1ccc(cc1)OCCCCCCn1c2ccccc2c2ccccc12)c1c(c(c(c(c1F)F)F)F)F |
| Title of publication | A novel carbazole-based gold(i) complex with interesting solid-state, multistimuli-responsive characteristics. |
| Authors of publication | Chen, Zhao; Liang, Jinhua; Nie, Yuting; Xu, Xuqingfeng; Yu, Guang-Ao; Yin, Jun; Liu, Sheng Hua |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2015 |
| Journal volume | 44 |
| Journal issue | 40 |
| Pages of publication | 17473 - 17477 |
| a | 7.624 ± 0.0011 Å |
| b | 13.6244 ± 0.0018 Å |
| c | 14.516 ± 0.002 Å |
| α | 102.723 ± 0.002° |
| β | 100.056 ± 0.002° |
| γ | 105.814 ± 0.002° |
| Cell volume | 1370.2 ± 0.3 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0414 |
| Residual factor for significantly intense reflections | 0.0366 |
| Weighted residual factors for significantly intense reflections | 0.1131 |
| Weighted residual factors for all reflections included in the refinement | 0.1207 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.103 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176428 (current) | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
7036480.cif |
| 161924 | 2015-10-09 | cif/ Updating files of 7036480, 7036481 Original log message: Adding full bibliography for 7036480--7036481.cif. |
7036480.cif |
| 155864 | 2015-09-11 | cif/ Adding structures of 7036480, 7036481 via cif-deposit CGI script. |
7036480.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.