Crystallography Open Database

Information card for entry 1550817

Preview

Coordinates	1550817.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C194 H412 Ag84 O90 S42 W14
Calculated formula	C194 H412 Ag84 O90 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	20.2607 ± 0.0002 Å
b	20.6711 ± 0.0002 Å
c	26.2425 ± 0.0003 Å
α	109.714 ± 0.001°
β	100.1 ± 0.001°
γ	109.009 ± 0.001°
Cell volume	9266.3 ± 0.2 Å³
Cell temperature	99.99 ± 0.1 K
Ambient diffraction temperature	99.99 ± 0.1 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	0.0637
Residual factor for significantly intense reflections	0.0578
Weighted residual factors for significantly intense reflections	0.1548
Weighted residual factors for all reflections included in the refinement	0.1596
Goodness-of-fit parameter for all reflections included in the refinement	1.041
Diffraction radiation probe	x-ray
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
282777 (current)	2023-04-20	cod/ (saulius@starta) Updating COD bibliographies for 271 COD entries identified by R.M.	1550817.cif
214419	2019-03-30	cif/ Adding structures of 1550817, 1550818 via cif-deposit CGI script.	1550817.cif