Information card for entry 1566837
| Formula |
C22 H17 N3 |
| Calculated formula |
C22 H17 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 |
7.5636 ± 0.0002 Å |
| b |
10.607 ± 0.0003 Å |
| c |
11.488 ± 0.0003 Å |
| α |
104.037 ± 0.002° |
| β |
99.019 ± 0.002° |
| γ |
104.02 ± 0.003° |
| Cell volume |
844.45 ± 0.04 Å3 |
| Cell temperature |
293 ± 2 K |
| Ambient diffraction temperature |
293 ± 2 K |
| Number of distinct elements |
3 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0503 |
| Residual factor for significantly intense reflections |
0.0415 |
| Weighted residual factors for significantly intense reflections |
0.1057 |
| Weighted residual factors for all reflections included in the refinement |
0.111 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.048 |
| Diffraction radiation wavelength |
1.3405 Å |
| Diffraction radiation type |
GaKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/1566837.html
