Crystallography Open Database

Information card for entry 4126964

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Coordinates	4126964.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C73 H150.72 Ag23 N11 O28 S10
Calculated formula	C73 H150.72 Ag23 N11 O28 S10
Title of publication	Atom-precise Modification of Silver(I) Thiolate Cluster by Shell Ligand Substitution: A New Approach to Generation of Cluster Functionality and Chirality.
Authors of publication	Li, Si; Du, Xiang-Sha; Li, Bing; Wang, Jia-Yin; Li, Guo-Ping; Gao, Guang-Gang; Zang, Shuang-Quan
Journal of publication	Journal of the American Chemical Society
Year of publication	2017
a	12.7881 ± 0.0006 Å
b	19.0112 ± 0.0009 Å
c	29.1847 ± 0.0014 Å
α	90°
β	101.212 ± 0.0015°
γ	90°
Cell volume	6959.9 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0767
Residual factor for significantly intense reflections	0.0463
Weighted residual factors for significantly intense reflections	0.1037
Weighted residual factors for all reflections included in the refinement	0.116
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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