Crystallography Open Database

Information card for entry 2244245

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Structure parameters

Chemical name	<i>N</i>-(5-Acetyl-4-methylpyrimidin-2-yl)benzenesulfonamide
Formula	C13 H13 N3 O3 S
Calculated formula	C13 H13 N3 O3 S
Title of publication	Synthesis and crystal structure of <i>N</i>-(5-acetyl-4-methyl-pyrimidin-2-yl)benzene-sulfonamide.
Authors of publication	Mohamed-Ezzat, Reham A; Kariuki, Benson M.; Azzam, Rasha A.
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2023
Journal volume	79
Journal issue	Pt 4
Pages of publication	331 - 334
a	10.0699 ± 0.0006 Å
b	14.7429 ± 0.0006 Å
c	10.5212 ± 0.0007 Å
α	90°
β	113.9 ± 0.007°
γ	90°
Cell volume	1428.04 ± 0.16 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0689
Residual factor for significantly intense reflections	0.0459
Weighted residual factors for significantly intense reflections	0.1093
Weighted residual factors for all reflections included in the refinement	0.1251
Goodness-of-fit parameter for all reflections included in the refinement	1.065
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

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