Crystallography Open Database

Information card for entry 2239047

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Structure parameters

Chemical name	<i>N</i>-(3-Chloro-1-methyl-1<i>H</i>-indazol-5-yl)-4-methylbenzenesulfonamide
Formula	C15 H14 Cl N3 O2 S
Calculated formula	C15 H14 Cl N3 O2 S
SMILES	Cc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)c(Cl)nn2C
Title of publication	<i>N</i>-(3-Chloro-1-methyl-1<i>H</i>-indazol-5-yl)-4-methylbenzenesulfonamide
Authors of publication	Chicha, Hakima; Rakib, El Mostapha; Amiri, Ouafa; Saadi, Mohamed; El Ammari, Lahcen
Journal of publication	Acta Crystallographica Section E
Year of publication	2014
Journal volume	70
Journal issue	2
Pages of publication	o181
a	8.458 ± 0.0013 Å
b	34.92 ± 0.006 Å
c	10.8333 ± 0.0017 Å
α	90°
β	97.226 ± 0.007°
γ	90°
Cell volume	3174.2 ± 0.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0669
Residual factor for significantly intense reflections	0.0482
Weighted residual factors for significantly intense reflections	0.1254
Weighted residual factors for all reflections included in the refinement	0.1369
Goodness-of-fit parameter for all reflections included in the refinement	1.043
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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