Crystallography Open Database

Information card for entry 4127021

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Coordinates	4127021.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H96 Ag14 B60 N12 S12
Calculated formula	C36 H96 Ag14 B60 N12 S12
Title of publication	Atomically Precise Site-Specific Tailoring and Directional Assembly of Superatomic Silver Nanoclusters.
Authors of publication	Wang, Zhao-Yang; Wang, Meng-Qi; Li, Yan-Ling; Luo, Peng; Jia, Tong-Tong; Huang, Ren-Wu; Zang, Shuang-Quan; Mak, Thomas C. W.
Journal of publication	Journal of the American Chemical Society
Year of publication	2018
a	14.7109 ± 0.0009 Å
b	14.8752 ± 0.0006 Å
c	15.142 ± 0.0009 Å
α	84.784 ± 0.004°
β	60.966 ± 0.006°
γ	84.106 ± 0.004°
Cell volume	2878.6 ± 0.3 Å³
Cell temperature	149.99 ± 0.1 K
Ambient diffraction temperature	149.99 ± 0.1 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0918
Residual factor for significantly intense reflections	0.0826
Weighted residual factors for significantly intense reflections	0.2236
Weighted residual factors for all reflections included in the refinement	0.2364
Goodness-of-fit parameter for all reflections included in the refinement	1.045
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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