Crystallography Open Database

Information card for entry 1572881

Preview

Coordinates	1572881.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C147.36 H170.13 Au25 N O S18
Calculated formula	C147.362 H170.128 Au25 N O S18
Title of publication	Quantitative analysis of air-oxidation reactions of thiolate-protected gold nanoclusters.
Authors of publication	Suzuki, Wataru; Takahata, Ryo; Mizuhata, Yoshiyuki; Tokitoh, Norihiro; Xue, Songlin; Teranishi, Toshiharu
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	45
Pages of publication	18896 - 18902
a	17.0841 ± 0.0008 Å
b	20.5511 ± 0.001 Å
c	26.5333 ± 0.0012 Å
α	73.391 ± 0.002°
β	72.258 ± 0.002°
γ	65.634 ± 0.002°
Cell volume	7943.6 ± 0.7 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 2 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	0.0444
Residual factor for significantly intense reflections	0.0306
Weighted residual factors for significantly intense reflections	0.0648
Weighted residual factors for all reflections included in the refinement	0.0703
Goodness-of-fit parameter for all reflections included in the refinement	1.033
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
296433 (current)	2024-12-06	cif/ Updating files of 1572881 Original log message: Adding full bibliography for 1572881.cif.	1572881.cif
295525	2024-10-18	cif/ Adding structures of 1572881 via cif-deposit CGI script.	1572881.cif