Information card for entry 1545648
Chemical name |
3,4-Dihydro-2<i>H</i>-benzo[4,5]imidazo[2,1-<i>b</i>][1,3]thiazin-3-ol |
Formula |
C10 H10 N2 O S |
Calculated formula |
C10 H10 N2 O S |
SMILES |
c12ccccc1nc1n2CC(CS1)O |
Title of publication |
3,4-Dihydro-2<i>H</i>-benzo[4,5]imidazo[2,1-<i>b</i>][1,3]thiazin-3-ol |
Authors of publication |
El Ouassif, Latifa; El Ghoul, Mostafa; Achour, Redouane; Saadi, Mohamed; El Ammari, Lahcen |
Journal of publication |
IUCrData |
Year of publication |
2017 |
Journal volume |
2 |
Journal issue |
3 |
Pages of publication |
x170429 |
a |
17.57 ± 0.003 Å |
b |
6.3994 ± 0.001 Å |
c |
8.869 ± 0.0015 Å |
α |
90° |
β |
95.641 ± 0.008° |
γ |
90° |
Cell volume |
992.4 ± 0.3 Å3 |
Cell temperature |
296 ± 2 K |
Ambient diffraction temperature |
296 ± 2 K |
Number of distinct elements |
5 |
Space group number |
14 |
Hermann-Mauguin space group symbol |
P 1 21/c 1 |
Hall space group symbol |
-P 2ybc |
Residual factor for all reflections |
0.0519 |
Residual factor for significantly intense reflections |
0.0437 |
Weighted residual factors for significantly intense reflections |
0.1189 |
Weighted residual factors for all reflections included in the refinement |
0.1262 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.083 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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The link is:
https://www.crystallography.net/1545648.html