Information card for entry 7232225
| Chemical name |
2-oxo-3,4-dichloro-2,5-dihydrofuran-5-ylsulfonyl) ethanoic acid |
| Formula |
C6 H4 Cl2 O6 S |
| Calculated formula |
C6 H4 Cl2 O6 S |
| Title of publication |
“Lp⋯synthon” interaction as a reason for the strong amplification of synthon-forming hydrogen bonds |
| Authors of publication |
Lodochnikova, Olga A.; Latypova, Liliya Z.; Madzhidov, Timur I.; Chmutova, Galina A.; Voronina, Julia K.; Gubaidullin, Aidar T.; Kurbangalieva, Almira R. |
| Journal of publication |
CrystEngComm |
| Year of publication |
2019 |
| Journal volume |
21 |
| Journal issue |
9 |
| Pages of publication |
1499 |
| a |
7.2451 ± 0.001 Å |
| b |
7.8674 ± 0.001 Å |
| c |
16.65 ± 0.002 Å |
| α |
87.647 ± 0.009° |
| β |
86.278 ± 0.009° |
| γ |
83.882 ± 0.009° |
| Cell volume |
941.1 ± 0.2 Å3 |
| Cell temperature |
150 ± 2 K |
| Ambient diffraction temperature |
150 ± 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 |
0.0357 |
| Residual factor for significantly intense reflections |
0.0304 |
| Weighted residual factors for significantly intense reflections |
0.073 |
| Weighted residual factors for all reflections included in the refinement |
0.076 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.055 |
| Diffraction radiation probe |
x-ray |
| Diffraction radiation wavelength |
0.71073 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/7232225.html
