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Information card for entry 1566841
Preview
| Coordinates | 1566841.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H25 Cl2 N3 |
|---|---|
| Calculated formula | C38 H23 Cl2 N3 |
| Title of publication | Synthesis of Unsymmetrically Tetrasubstituted Pyrroles and Studies of AIEE in Pyrrolo[1,2-a]pyrimidine Derivatives |
| Authors of publication | Li, Taian; Chiou, Mong-Feng; Li, Yajun; Ye, Changqing; Su, Min; Xue, Mengyu; Yuan, Xiaobin; Wang, Chuanchuan; Wan, Wen-Ming; Li, Daliang; Bao, Hongli |
| Journal of publication | Chemical Science |
| Year of publication | 2022 |
| a | 11.6662 ± 0.0004 Å |
| b | 23.9537 ± 0.0007 Å |
| c | 12.582 ± 0.0004 Å |
| α | 90° |
| β | 115.611 ± 0.004° |
| γ | 90° |
| Cell volume | 3170.6 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1305 |
| Residual factor for significantly intense reflections | 0.1166 |
| Weighted residual factors for significantly intense reflections | 0.3977 |
| Weighted residual factors for all reflections included in the refinement | 0.4111 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.755 |
| Diffraction radiation wavelength | 1.3405 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274606 (current) | 2022-04-21 | cif/ Adding structures of 1566835, 1566836, 1566837, 1566838, 1566839, 1566840, 1566841, 1566842, 1566843 via cif-deposit CGI script. |
1566841.cif |
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Users of the data should acknowledge the original authors of the
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