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Information card for entry 7234147
Preview
| Coordinates | 7234147.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C42 H26 B F2 N5 S2 |
|---|---|
| Calculated formula | C42 H26 B F2 N5 S2 |
| SMILES | S1c2c(N(c3cc4c([n]5c(N=c6n(c7ccc(N8c9ccccc9Sc9c8cccc9)cc7cc6)[B]5(F)F)cc4)cc3)c3ccccc13)cccc2 |
| Title of publication | Aza-boron-diquinomethene complexes bearing N-aryl chromophores: synthesis, crystal structures, tunable photophysics, the protonation effect and their application as pH sensors |
| Authors of publication | Xiaolin Zhu; Hai Huang; Rui Liu; Xiaodong Jin; Yuhao Li; Danfeng Wang; Qiang Wang; Hongjun Zhu |
| Journal of publication | Journal of Materials Chemistry C |
| Year of publication | 2015 |
| Journal volume | 3 |
| Pages of publication | 3774 - 3782 |
| a | 8.2448 ± 0.0013 Å |
| b | 13.187 ± 0.002 Å |
| c | 19.061 ± 0.003 Å |
| α | 100.053 ± 0.014° |
| β | 95.703 ± 0.013° |
| γ | 95.546 ± 0.012° |
| Cell volume | 2016.7 ± 0.6 Å3 |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.169 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 218832 (current) | 2019-09-25 | cif/ Adding structures of 7234146, 7234147, 7234148 via cif-deposit CGI script. |
7234147.cif |
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Users of the data should acknowledge the original authors of the
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