Information card for entry 4030235
| Formula |
C31 H46 Br2 N2 O9 |
| Calculated formula |
C31 H46 Br2 N2 O9 |
| Title of publication |
Synthesis, structure, and properties of supramolecular photoswitches based on ammonioalkyl derivatives of crown ether styryl dyes. |
| Authors of publication |
Gromov, Sergey P.; Vedernikov, Artem I.; Lobova, Natalia A.; Kuz'mina, Lyudmila G.; Dmitrieva, Svetlana N.; Strelenko, Yuri A.; Howard, Judith A. K. |
| Journal of publication |
The Journal of organic chemistry |
| Year of publication |
2014 |
| Journal volume |
79 |
| Journal issue |
23 |
| Pages of publication |
11416 - 11430 |
| a |
11.431 ± 0.0011 Å |
| b |
11.6678 ± 0.0011 Å |
| c |
14.7274 ± 0.0014 Å |
| α |
104.737 ± 0.002° |
| β |
95.77 ± 0.002° |
| γ |
114.086 ± 0.002° |
| Cell volume |
1687.2 ± 0.3 Å3 |
| Cell temperature |
120 ± 2 K |
| Ambient diffraction temperature |
120 ± 2 K |
| Number of distinct elements |
5 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0947 |
| Residual factor for significantly intense reflections |
0.0593 |
| Weighted residual factors for significantly intense reflections |
0.1646 |
| Weighted residual factors for all reflections included in the refinement |
0.1786 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.038 |
| 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/4030235.html
