Information card for entry 7122834
| Formula |
C29 H27 N5 O7 |
| Calculated formula |
C29 H27 N5 O7 |
| Title of publication |
Fluoride binding by an anionic receptor: tuning the acidity of amide NH groups for basic anion hydrogen bonding and recognition |
| Authors of publication |
Caltagirone, Claudia; Montis, Riccardo; Lippolis, Vito; Bencini, Andrea; Conti, Luca; Giorgi, Claudia; Horton, Peter; Coles, Simon; Mapp, Lucy K.; Gale, Philip A.; Fusaro, Luca |
| Journal of publication |
Chemical Communications |
| Year of publication |
2019 |
| a |
9.4201 ± 0.0016 Å |
| b |
13.601 ± 0.002 Å |
| c |
10.951 ± 0.0018 Å |
| α |
90° |
| β |
109.325 ± 0.008° |
| γ |
90° |
| Cell volume |
1324 ± 0.4 Å3 |
| Cell temperature |
170 K |
| Ambient diffraction temperature |
170 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
4 |
| Hermann-Mauguin space group symbol |
P 1 21 1 |
| Hall space group symbol |
P 2yb |
| Residual factor for all reflections |
0.1223 |
| Residual factor for significantly intense reflections |
0.0634 |
| Weighted residual factors for significantly intense reflections |
0.1032 |
| Weighted residual factors for all reflections included in the refinement |
0.1204 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.027 |
| Diffraction radiation probe |
x-ray |
| Diffraction radiation wavelength |
0.71075 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/7122834.html
