Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1550839
Preview
| Coordinates | 1550839.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H42 N4 O3 |
|---|---|
| Calculated formula | C34 H42 N4 O3 |
| Title of publication | A H-Bond Strategy to Develop Acid-Resistant Photoswitchable Rhodamine Spirolactams for Super-Resolution Single-Molecule Localization Microscopy |
| Authors of publication | Qi, Qingkai; Chi, Weijie; Li, Yuanyuan; Qiao, Qinglong; Chen, Jie; Miao, Lu; Zhang, Yi; Li, Jin; Ji, Wei; Xu, Tao; Liu, Xiaogang; Yoon, Juyoung; Xu, Zhaochao |
| Journal of publication | Chemical Science |
| Year of publication | 2019 |
| a | 21.0138 ± 0.0012 Å |
| b | 10.9924 ± 0.0007 Å |
| c | 26.662 ± 0.0016 Å |
| α | 90° |
| β | 97.694 ± 0.005° |
| γ | 90° |
| Cell volume | 6103.3 ± 0.6 Å3 |
| Cell temperature | 128 ± 2 K |
| Ambient diffraction temperature | 128.15 K |
| Number of distinct elements | 4 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor for all reflections | 0.0857 |
| Residual factor for significantly intense reflections | 0.0799 |
| Weighted residual factors for significantly intense reflections | 0.1927 |
| Weighted residual factors for all reflections included in the refinement | 0.1963 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.132 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 214492 (current) | 2019-04-05 | cif/ Adding structures of 1550837, 1550838, 1550839, 1550840 via cif-deposit CGI script. |
1550839.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.