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Information card for entry 7235869
Preview
| Coordinates | 7235869.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C51 H36 Cl2 N4 O2 |
|---|---|
| Calculated formula | C51 H36 Cl2 N4 O2 |
| Title of publication | An ESIPT fluorescent dye based on HBI with high quantum yield and large Stokes shift for selective detection of Cys |
| Authors of publication | Zhang, Ying; Wang, Jun-Hao; Zheng, Wenjie; Chen, Tianfeng; Tong, Qing-Xiao; Li, Dan |
| Journal of publication | J. Mater. Chem. B |
| Year of publication | 2014 |
| Journal volume | 2 |
| Journal issue | 26 |
| Pages of publication | 4159 |
| a | 12.0614 ± 0.001 Å |
| b | 12.2502 ± 0.001 Å |
| c | 14.7645 ± 0.0013 Å |
| α | 87.449 ± 0.007° |
| β | 85.384 ± 0.007° |
| γ | 72.203 ± 0.007° |
| Cell volume | 2069.9 ± 0.3 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 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 | 0.0832 |
| Residual factor for significantly intense reflections | 0.072 |
| Weighted residual factors for significantly intense reflections | 0.2514 |
| Weighted residual factors for all reflections included in the refinement | 0.2817 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 233396 (current) | 2019-11-23 | cif/ Adding structures of 7235869 via cif-deposit CGI script. |
7235869.cif |
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Users of the data should acknowledge the original authors of the
structural data.