Information card for entry 4518141
| Formula |
C41 H23 Cl6.75 N2 O4 |
| Calculated formula |
C40.9475 H22.9475 Cl6.8425 N2 O4 |
| Title of publication |
Surface-Doped Quasi-2D Chiral Organic Single Crystals for Chiroptical Sensing |
| Authors of publication |
Shang, Xiaobo; Song, Inho; Lee, Jeong Hyeon; Choi, Wanuk; Ahn, Jaeyong; Ohtsu, Hiroyoshi; Kim, Jin Chul; Koo, Jin Young; Kwak, Sang Kyu; Oh, Joon Hak |
| Journal of publication |
ACS Nano |
| Year of publication |
2020 |
| a |
11.486 ± 0.002 Å |
| b |
30.043 ± 0.006 Å |
| c |
11.821 ± 0.002 Å |
| α |
90° |
| β |
118.92 ± 0.03° |
| γ |
90° |
| Cell volume |
3570.4 ± 1.5 Å3 |
| Cell temperature |
100 ± 2 K |
| Ambient diffraction temperature |
100 ± 2 K |
| Number of distinct elements |
5 |
| Space group number |
4 |
| Hermann-Mauguin space group symbol |
P 1 21 1 |
| Hall space group symbol |
P 2yb |
| Residual factor for all reflections |
0.0452 |
| Residual factor for significantly intense reflections |
0.0433 |
| Weighted residual factors for significantly intense reflections |
0.1136 |
| Weighted residual factors for all reflections included in the refinement |
0.1152 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.065 |
| Diffraction radiation wavelength |
0.66002 Å |
| Diffraction radiation type |
synchrotron |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/4518141.html
