Information card for entry 2237106
| Chemical name |
6-Ethoxycarbonyl-5,7-dihydroxy-2,3-dihydro-1<i>H</i>- pyrido[3,2,1-<i>ij</i>]quinolinium tribromide |
| Formula |
C15 H16 Br3 N O4 |
| Calculated formula |
C15 H16 Br3 N O4 |
| Title of publication |
6-Ethoxycarbonyl-5,7-dihydroxy-2,3-dihydro-1<i>H</i>-pyrido[3,2,1-<i>ij</i>]quinolinium tribromide |
| Authors of publication |
Rybakov, Victor B.; Shishkina, Svitlana V.; Ukrainets, Igor V.; Golik, Nikolai Yu.; Chernenok, Igor N. |
| Journal of publication |
Acta Crystallographica Section E |
| Year of publication |
2013 |
| Journal volume |
69 |
| Journal issue |
1 |
| Pages of publication |
o82 |
| a |
7.6491 ± 0.0008 Å |
| b |
9.1729 ± 0.001 Å |
| c |
13.3722 ± 0.0014 Å |
| α |
102.355 ± 0.009° |
| β |
98.777 ± 0.009° |
| γ |
98.093 ± 0.009° |
| Cell volume |
891.05 ± 0.17 Å3 |
| Cell temperature |
295 ± 2 K |
| Ambient diffraction temperature |
295 ± 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 |
0.19 |
| Residual factor for significantly intense reflections |
0.0676 |
| Weighted residual factors for significantly intense reflections |
0.1749 |
| Weighted residual factors for all reflections included in the refinement |
0.2171 |
| Goodness-of-fit parameter for all reflections included in the refinement |
0.895 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
Yes |
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https://www.crystallography.net/2237106.html
