Information card for entry 2216878
Chemical name |
4-Methoxy-N-[6-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]benzenesulfonamide |
Formula |
C15 H14 N2 O3 S2 |
Calculated formula |
C15 H14 N2 O3 S2 |
SMILES |
c12c(ccc(c1)C)NC(=NS(=O)(=O)c1ccc(cc1)OC)S2 |
Title of publication |
4-Methoxy-<i>N</i>-[6-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]benzenesulfonamide |
Authors of publication |
Navarrete-Vázquez, Gabriel; Moreno-Diaz, Hermenegilda; Villalobos-Molina, Rafael; Estrada-Soto, Samuel; Tlahuext, Hugo |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2008 |
Journal volume |
64 |
Journal issue |
1 |
Pages of publication |
o227 - o227 |
a |
12.0173 ± 0.0015 Å |
b |
16.211 ± 0.002 Å |
c |
7.7377 ± 0.001 Å |
α |
90° |
β |
99.973 ± 0.002° |
γ |
90° |
Cell volume |
1484.6 ± 0.3 Å3 |
Cell temperature |
273 ± 2 K |
Ambient diffraction temperature |
273 ± 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 |
0.0514 |
Residual factor for significantly intense reflections |
0.0476 |
Weighted residual factors for significantly intense reflections |
0.1149 |
Weighted residual factors for all reflections included in the refinement |
0.1174 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.149 |
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/2216878.html