Crystallography Open Database

Information card for entry 4308411

Preview

Coordinates	4308411.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	(4-methylphenyl)sulfonyl)-imino-1H-4-methyl-2-pyridine
Chemical name	(4-methylphenyl)sulfonyl]-imino-1H-4-methyl-2-pyridine
Formula	C13 H14 N2 O2 S
Calculated formula	C13 H14 N2 O2 S
SMILES	S(=O)(=O)(N=c1[nH]ccc(c1)C)c1ccc(cc1)C
Title of publication	Electrochemical Synthesis and Structural Characterization of Silver(I) Complexes ofN-2-Pyridyl Sulfonamide Ligands with Different Nuclearity: Influence of the Steric Hindrance at the Pyridine Ring and the Sulfonamide Group on the Structure of the Complexes
Authors of publication	Beloso, Inmaculada; Castro, Jesús; García-Vázquez, José A.; Pérez-Lourido, Paulo; Romero, Jaime; Sousa, Antonio
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Journal issue	2
Pages of publication	336 - 351
a	10.8901 ± 0.0009 Å
b	15.5093 ± 0.0013 Å
c	15.8472 ± 0.0014 Å
α	90°
β	102.689 ± 0.002°
γ	90°
Cell volume	2611.2 ± 0.4 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/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1905
Residual factor for significantly intense reflections	0.0447
Weighted residual factors for significantly intense reflections	0.0619
Weighted residual factors for all reflections included in the refinement	0.0774
Goodness-of-fit parameter for all reflections included in the refinement	0.806
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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