Information card for entry 7060896
| Formula |
C28 H46 Cl4 N6 O20 |
| Calculated formula |
C28 H46 Cl4 N6 O20 |
| Title of publication |
Protonation of cyclen-based chelating agents containing fluorescent moieties |
| Authors of publication |
Bartoli, Francesco; Conti, Luca; Romano, Giammarco Maria; Massai, Lara; Paoli, Paola; Rossi, Patrizia; Pietraperzia, Giangaetano; Gellini, Cristina; Bencini, Andrea |
| Journal of publication |
New Journal of Chemistry |
| Year of publication |
2021 |
| Journal volume |
45 |
| Journal issue |
36 |
| Pages of publication |
16926 - 16938 |
| a |
14.6135 ± 0.0007 Å |
| b |
8.3808 ± 0.0004 Å |
| c |
31.815 ± 0.001 Å |
| α |
90° |
| β |
91.948 ± 0.004° |
| γ |
90° |
| Cell volume |
3894.2 ± 0.3 Å3 |
| Cell temperature |
150 K |
| Ambient diffraction temperature |
150 K |
| Number of distinct elements |
5 |
| Space group number |
14 |
| Hermann-Mauguin space group symbol |
P 1 21/n 1 |
| Hall space group symbol |
-P 2yn |
| Residual factor for all reflections |
0.1541 |
| Residual factor for significantly intense reflections |
0.0994 |
| Weighted residual factors for significantly intense reflections |
0.1695 |
| Weighted residual factors for all reflections included in the refinement |
0.1911 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.126 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7060896.html
