Crystallography Open Database

Information card for entry 1559956

Preview

Coordinates	1559956.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C240 H270 Au38 Cd4 S30
Calculated formula	C240 H270 Au38 Cd4 S30
Title of publication	Cd-driven surface reconstruction and photodynamics in gold nanoclusters
Authors of publication	Liu, Xu; Yao, Guo; Cheng, Xinglian; Xu, Jiayu; Cai, Xiao; Hu, Weigang; Xu, Wen Wu; Zhang, Chunfeng; Zhu, Yan
Journal of publication	Chemical Science
Year of publication	2021
Journal volume	12
Journal issue	9
Pages of publication	3290 - 3294
a	35.243 ± 0.003 Å
b	36.193 ± 0.003 Å
c	46.321 ± 0.004 Å
α	78.898 ± 0.003°
β	74.68 ± 0.003°
γ	79.183 ± 0.003°
Cell volume	55332 ± 8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1086
Residual factor for significantly intense reflections	0.0551
Weighted residual factors for significantly intense reflections	0.1486
Weighted residual factors for all reflections included in the refinement	0.175
Goodness-of-fit parameter for all reflections included in the refinement	0.953
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
263693 (current)	2021-04-05	cif/ Updating files of 1559955, 1559956 Original log message: Adding full bibliography for 1559955--1559956.cif.	1559956.cif
260547	2021-01-06	cif/ Adding structures of 1559955, 1559956 via cif-deposit CGI script.	1559956.cif