Crystallography Open Database

Information card for entry 1543881

Preview

Coordinates	1543881.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C240 H312 Ag4 Au32 S24
Calculated formula	C240 H310 Ag4 Au32 S24
Title of publication	The solely motif-doped Au36-xAgx(SPh-tBu)24 (x = 1-8) nanoclusters: X-ray crystal structure and optical properties.
Authors of publication	Fan, Jiqiang; Song, Yongbo; Chai, Jinsong; Yang, Sha; Chen, Tao; Rao, Bo; Yu, Haizhu; Zhu, Manzhou
Journal of publication	Nanoscale
Year of publication	2016
Journal volume	8
Journal issue	33
Pages of publication	15317 - 15322
a	58.539 ± 0.004 Å
b	34.472 ± 0.002 Å
c	41.488 ± 0.003 Å
α	90°
β	91.2322 ± 0.0009°
γ	90°
Cell volume	83702 ± 10 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293.15 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1859
Residual factor for significantly intense reflections	0.0828
Weighted residual factors for significantly intense reflections	0.2137
Weighted residual factors for all reflections included in the refinement	0.2441
Goodness-of-fit parameter for all reflections included in the refinement	1.093
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
187157 (current)	2016-10-08	cif/ Updating files of 1543881 Original log message: Adding full bibliography for 1543881.cif.	1543881.cif
185726	2016-08-10	cif/ Adding structures of 1543881 via cif-deposit CGI script.	1543881.cif