Crystallography Open Database

Information card for entry 2023060

2023059 << 2023060 >> 2023061

Preview

Coordinates	2023060.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Tribromido[di-<i>tert</i>-butyl(propan-2-yl)phosphane sulfide-κ<i>S</i>]gold(III)
Formula	C11 H25 Au Br3 P S
Calculated formula	C11 H25 Au Br3 P S
Title of publication	Crystal structures of ten phosphane chalcogenide complexes of gold(III) chloride and bromide.
Authors of publication	Upmann, Daniel; Bockfeld, Dirk; Jones, Peter G.; Târcoveanu, Eliza
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2024
Journal volume	80
Journal issue	Pt 4
Pages of publication	355 - 369
a	8.6067 ± 0.0008 Å
b	10.1161 ± 0.0012 Å
c	11.5123 ± 0.0012 Å
α	77.873 ± 0.01°
β	70.257 ± 0.01°
γ	71.867 ± 0.01°
Cell volume	890.37 ± 0.18 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0192
Residual factor for significantly intense reflections	0.0174
Weighted residual factors for significantly intense reflections	0.0357
Weighted residual factors for all reflections included in the refinement	0.0362
Goodness-of-fit parameter for all reflections included in the refinement	1.135
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
291733 (current)	2024-05-06	cif/ Updating files of 2023050, 2023051, 2023052, 2023053, 2023054, 2023055, 2023056, 2023057, 2023058, 2023059, 2023060, 2023061, 2023062 Original log message: Adding full bibliography for 2023050--2023062.cif.	2023060.cif
290478	2024-03-13	cif/ Adding structures of 2023050, 2023051, 2023052, 2023053, 2023054, 2023055, 2023056, 2023057, 2023058, 2023059, 2023060, 2023061, 2023062 via cif-deposit CGI script.	2023060.cif