Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7238537
Preview
| Coordinates | 7238537.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C19 H17 B F2 O4 |
|---|---|
| Calculated formula | C19 H17 B F2 O4 |
| Title of publication | A mechanistic investigation of mechanochromic luminescent organoboron materials |
| Authors of publication | Sun, Xingxing; Zhang, Xuepeng; Li, Xinyang; Liu, Shiyong; Zhang, Guoqing |
| Journal of publication | Journal of Materials Chemistry |
| Year of publication | 2012 |
| Journal volume | 22 |
| Journal issue | 33 |
| Pages of publication | 17332 |
| a | 10.6842 ± 0.0007 Å |
| b | 7.2837 ± 0.0004 Å |
| c | 12.8423 ± 0.0007 Å |
| α | 90° |
| β | 120.355 ± 0.007° |
| γ | 90° |
| Cell volume | 862.39 ± 0.11 Å3 |
| Cell temperature | 291 ± 2 K |
| Ambient diffraction temperature | 291 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 7 |
| Hermann-Mauguin space group symbol | P 1 c 1 |
| Hall space group symbol | P -2yc |
| Residual factor for all reflections | 0.0807 |
| Residual factor for significantly intense reflections | 0.0727 |
| Weighted residual factors for significantly intense reflections | 0.1812 |
| Weighted residual factors for all reflections included in the refinement | 0.1899 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244222 (current) | 2019-11-28 | cif/ Adding structures of 7238536, 7238537, 7238538 via cif-deposit CGI script. |
7238537.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.