Crystallography Open Database

Information card for entry 2214214

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Original IUCr paper	HTML

Structure parameters

Chemical name	(2-Amino-3,5-dimethylbenzenesulfonato-κN)bis(3-methylisoquinoline- κN)silver(I)
Formula	C28 H28 Ag N3 O3 S
Calculated formula	C28 H28 Ag N3 O3 S
SMILES	[Ag]([n]1c(C)cc2c(c1)cccc2)([n]1c(C)cc2ccccc2c1)[NH2]c1c(cc(cc1C)C)S(=O)(=O)[O-]
Title of publication	(2-Amino-3,5-dimethylbenzenesulfonato-κ<i>N</i>)bis(3-methylisoquinoline-κ<i>N</i>)silver(I)
Authors of publication	Li, Yu-Jie; Shangguan, Shao-Ping; Dong, Xian-Wu
Journal of publication	Acta Crystallographica Section E
Year of publication	2007
Journal volume	63
Journal issue	7
Pages of publication	m1806 - m1806
a	11.91 ± 0.002 Å
b	11.199 ± 0.002 Å
c	19.507 ± 0.004 Å
α	90°
β	92.05 ± 0.03°
γ	90°
Cell volume	2600.2 ± 0.8 Å³
Cell temperature	292 ± 2 K
Ambient diffraction temperature	292 ± 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	0.1006
Residual factor for significantly intense reflections	0.0363
Weighted residual factors for significantly intense reflections	0.084
Weighted residual factors for all reflections included in the refinement	0.1157
Goodness-of-fit parameter for all reflections included in the refinement	0.905
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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