Crystallography Open Database

Information card for entry 1550818

Preview

Coordinates	1550818.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C246 H370 Ag84 O88 S42 W14
Calculated formula	C246 H370 Ag84 O88 S42 W14
Title of publication	Carboxylic acid stimulated silver shell isomerism in a triple core–shell Ag <sub>84</sub> nanocluster
Authors of publication	Wang, Zhi; Sun, Hao-Tian; Kurmoo, Mohamedally; Liu, Qing-Yun; Zhuang, Gui-Lin; Zhao, Quan-Qin; Wang, Xing-Po; Tung, Chen-Ho; Sun, Di
Journal of publication	Chemical Science
Year of publication	2019
Journal volume	10
Journal issue	18
Pages of publication	4862 - 4867
a	21.5617 ± 0.0011 Å
b	22.2473 ± 0.001 Å
c	24.5285 ± 0.0013 Å
α	74.1307 ± 0.0013°
β	70.9758 ± 0.0013°
γ	68.5642 ± 0.0017°
Cell volume	10193.5 ± 0.9 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100.15 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	0.0975
Residual factor for significantly intense reflections	0.0752
Weighted residual factors for significantly intense reflections	0.169
Weighted residual factors for all reflections included in the refinement	0.1919
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.68877 Å
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
282777 (current)	2023-04-20	cod/ (saulius@starta) Updating COD bibliographies for 271 COD entries identified by R.M.	1550818.cif
214419	2019-03-30	cif/ Adding structures of 1550817, 1550818 via cif-deposit CGI script.	1550818.cif