Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1552495
Preview
| Coordinates | 1552495.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C50 H47 I3 N2 O10 |
|---|---|
| Calculated formula | C50 H47 I3 N2 O10 |
| Title of publication | Spiropyran in Situ Switching: A Real-Time Fluorescence Strategy for Tracking DNA G-Quadruplexes in Live Cells. |
| Authors of publication | Li, Jin; Yin, Xinchi; Li, Bin; Li, Xiaokang; Pan, Yuanjiang; Li, Jian; Guo, Yuan |
| Journal of publication | Analytical chemistry |
| Year of publication | 2019 |
| Journal volume | 91 |
| Journal issue | 8 |
| Pages of publication | 5354 - 5361 |
| a | 8.299 ± 0.003 Å |
| b | 11.341 ± 0.004 Å |
| c | 13.58 ± 0.005 Å |
| α | 102.86 ± 0.005° |
| β | 90.495 ± 0.006° |
| γ | 100.374 ± 0.006° |
| Cell volume | 1224.1 ± 0.8 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296.15 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0817 |
| Residual factor for significantly intense reflections | 0.0491 |
| Weighted residual factors for significantly intense reflections | 0.1249 |
| Weighted residual factors for all reflections included in the refinement | 0.1458 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.959 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 220309 (current) | 2019-10-28 | cif/ Adding structures of 1552495 via cif-deposit CGI script. |
1552495.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.