Crystallography Open Database

Information card for entry 4103700

Preview

Coordinates	4103700.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C132 H316 Ag62 B4 F16 O10 S45
Calculated formula	C132 H288 Ag62 B4 F16 O10 S45
Title of publication	Luminescent Molecular Ag-S Nanocluster [Ag62S13(SBut)32](BF4)4
Authors of publication	Gen Li; Zhen Lei; Quan-Ming Wang
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	17678 - 17679
a	20.9194 ± 0.0007 Å
b	21.4218 ± 0.0004 Å
c	21.4404 ± 0.0008 Å
α	91.558 ± 0.002°
β	118.826 ± 0.004°
γ	115.036 ± 0.002°
Cell volume	7295.9 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1086
Residual factor for significantly intense reflections	0.0581
Weighted residual factors for significantly intense reflections	0.1645
Weighted residual factors for all reflections included in the refinement	0.1817
Goodness-of-fit parameter for all reflections included in the refinement	0.978
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178783 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/37.	4103700.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4103700.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4103700.cif
26733	2011-09-24	../uploads/cif-deposit/cod/cif Adding structures of 4103700 via cif-deposit CGI script.	4103700.cif