Information card for entry 2235041
Chemical name |
4-Hydroxy-2-methyl-1,1-dioxo-<i>N</i>-phenyl-2<i>H</i>- 1λ^6^,2-benzothiazine-3-carboxamide |
Formula |
C16 H14 N2 O4 S |
Calculated formula |
C16 H14 N2 O4 S |
SMILES |
S1(=O)(=O)N(C(=C(O)c2c1cccc2)C(=O)Nc1ccccc1)C |
Title of publication |
4-Hydroxy-2-methyl-1,1-dioxo-<i>N</i>-phenyl-2<i>H</i>-1λ^6^,2-benzothiazine-3-carboxamide |
Authors of publication |
Aman, Farhana; Siddiqui, Waseeq Ahmad; Ashraf, Adnan; Siddiqui, Hamid Latif; Parvez, Masood |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2012 |
Journal volume |
68 |
Journal issue |
6 |
Pages of publication |
o1790 |
a |
10.502 ± 0.002 Å |
b |
7.649 ± 0.003 Å |
c |
19.235 ± 0.004 Å |
α |
90° |
β |
103.395 ± 0.015° |
γ |
90° |
Cell volume |
1503.1 ± 0.7 Å3 |
Cell temperature |
173 ± 2 K |
Ambient diffraction temperature |
173 ± 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 |
0.0602 |
Residual factor for significantly intense reflections |
0.048 |
Weighted residual factors for significantly intense reflections |
0.1104 |
Weighted residual factors for all reflections included in the refinement |
0.1186 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.062 |
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/2235041.html