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Information card for entry 1543772
Preview
| Coordinates | 1543772.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C40 H34 N4 O2 |
|---|---|
| Calculated formula | C40 H34 N4 O2 |
| SMILES | O(C)CCOCCn1c2ccccc2c2c1ccc(c2)/C=C/c1ccc(c2cc(nc(c2)c2ncccc2)c2ncccc2)cc1 |
| Title of publication | Probe for simultaneous membrane and nucleus labeling in living cells and in vivo bioimaging using a two-photon absorption water-soluble Zn(ii) terpyridine complex with a reduced π-conjugation system. |
| Authors of publication | Tian, Xiaohe; Zhang, Qiong; Zhang, Mingzhu; Uvdal, Kajsa; Wang, Qin; Chen, Junyang; Du, Wei; Huang, Bei; Wu, Jieying; Tian, Yupeng |
| Journal of publication | Chemical science |
| Year of publication | 2017 |
| Journal volume | 8 |
| Journal issue | 1 |
| Pages of publication | 142 - 149 |
| a | 5.559 ± 0.005 Å |
| b | 11.24 ± 0.005 Å |
| c | 13.638 ± 0.005 Å |
| α | 75.767 ± 0.005° |
| β | 83.93 ± 0.005° |
| γ | 81.445 ± 0.005° |
| Cell volume | 814.7 ± 0.9 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 1 |
| Hermann-Mauguin space group symbol | P 1 |
| Hall space group symbol | P 1 |
| Residual factor for all reflections | 0.1104 |
| Residual factor for significantly intense reflections | 0.0661 |
| Weighted residual factors for significantly intense reflections | 0.157 |
| Weighted residual factors for all reflections included in the refinement | 0.1861 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301779 (current) | 2025-08-18 | Add cross-references to PubChem compounds in COD range 1/54 Each referenced PubChem compound corresponds to the full crystal structure. |
1543772.cif |
| 196313 | 2017-05-06 | cif/ Updating files of 1543770, 1543771, 1543772 Original log message: Adding full bibliography for 1543770--1543772.cif. |
1543772.cif |
| 191535 | 2017-02-04 | cif/ Updating files of 1543770, 1543771, 1543772 Original log message: Adding full bibliography for 1543770--1543772.cif. |
1543772.cif |
| 184803 | 2016-08-04 | cif/ Adding structures of 1543770, 1543771, 1543772 via cif-deposit CGI script. |
1543772.cif |
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Users of the data should acknowledge the original authors of the
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