Crystallography Open Database

Information card for entry 1558279

Preview

Coordinates	1558279.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C198 H88 Au42 F66
Calculated formula	C198 H88 Au42 F66
Title of publication	Homoleptic alkynyl-protected gold nanoclusters with unusual compositions and structures.
Authors of publication	Guan, Zong-Jie; Hu, Feng; Li, Jiao-Jiao; Liu, Zi-Rui; Wang, Quan-Ming
Journal of publication	Nanoscale
Year of publication	2020
Journal volume	12
Journal issue	25
Pages of publication	13346 - 13350
a	20.0369 ± 0.0008 Å
b	20.7253 ± 0.0013 Å
c	37.5767 ± 0.0007 Å
α	91.916 ± 0.003°
β	97.441 ± 0.002°
γ	118.103 ± 0.005°
Cell volume	13569.1 ± 1.2 Å³
Cell temperature	100.01 ± 0.12 K
Ambient diffraction temperature	100.01 ± 0.12 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.2276
Residual factor for significantly intense reflections	0.1675
Weighted residual factors for significantly intense reflections	0.3992
Weighted residual factors for all reflections included in the refinement	0.446
Goodness-of-fit parameter for all reflections included in the refinement	1.323
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
253933 (current)	2020-07-06	cif/ Updating files of 1558279, 1558280 Original log message: Adding full bibliography for 1558279--1558280.cif.	1558279.cif
253054	2020-06-10	cif/ Adding structures of 1558279, 1558280 via cif-deposit CGI script.	1558279.cif