Crystallography Open Database

Information card for entry 4003008

Preview

Coordinates	4003008.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C89.5 H86.9 Ag29 Cs3 N5.75 O7 S24
Calculated formula	C89.5 H86.9 Ag29 Cs3 N5.75 O7 S24
Title of publication	Capture of Cesium Ions with Nanoclusters: Effects on Inter- and Intramolecular Assembly
Authors of publication	Wei, Xiao; Kang, Xi; Yuan, Qianqin; Qin, Chenwanli; Jin, Shan; Wang, Shuxin; Zhu, Manzhou
Journal of publication	Chemistry of Materials
Year of publication	2019
Journal volume	31
Journal issue	13
Pages of publication	4945
a	35.1264 ± 0.0011 Å
b	27.9091 ± 0.001 Å
c	29.5657 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	28984.6 ± 1.8 Å³
Cell temperature	160 K
Ambient diffraction temperature	160 K
Number of distinct elements	7
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0736
Residual factor for significantly intense reflections	0.049
Weighted residual factors for significantly intense reflections	0.1305
Weighted residual factors for all reflections included in the refinement	0.1427
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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