Crystallography Open Database

Information card for entry 1568237

Preview

Coordinates	1568237.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C252 H252 Au20.31 Cu29.69 O36 S36
Calculated formula	C252 H252 Au20.312 Cu29.688 O36 S36
Title of publication	Alloying and dealloying of Au<sub>18</sub>Cu<sub>32</sub> nanoclusters at precise locations <i>via</i> controlling the electronegativity of substituent groups on thiol ligands.
Authors of publication	Tang, Li; Wang, Bin; Wang, Ru; Wang, Shuxin
Journal of publication	Nanoscale
Year of publication	2023
Journal volume	15
Journal issue	4
Pages of publication	1602 - 1608
a	21.3034 ± 0.0006 Å
b	21.5883 ± 0.0007 Å
c	21.9884 ± 0.0007 Å
α	111.776 ± 0.002°
β	118.542 ± 0.002°
γ	96.201 ± 0.002°
Cell volume	7728.8 ± 0.5 Å³
Cell temperature	170 K
Ambient diffraction temperature	170 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	0.1201
Residual factor for significantly intense reflections	0.09
Weighted residual factors for significantly intense reflections	0.2464
Weighted residual factors for all reflections included in the refinement	0.2691
Goodness-of-fit parameter for all reflections included in the refinement	1.057
Diffraction radiation wavelength	1.54186 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
281490 (current)	2023-03-04	cif/ Updating files of 1568236, 1568237 Original log message: Adding full bibliography for 1568236--1568237.cif.	1568237.cif
280136	2023-01-06	cif/ Adding structures of 1568236, 1568237 via cif-deposit CGI script.	1568237.cif