Crystallography Open Database

Information card for entry 2023052

2023051 << 2023052 >> 2023053

Preview

Coordinates	2023052.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	(<i>tert</i>-Butyldipropan-2-ylphosphane sulfide-κ<i>S</i>)trichloridogold(III)
Formula	C10 H23 Au Cl3 P S
Calculated formula	C10 H23 Au Cl3 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	7.9363 ± 0.0003 Å
b	14.4096 ± 0.0004 Å
c	14.2851 ± 0.0004 Å
α	90°
β	91.774 ± 0.003°
γ	90°
Cell volume	1632.85 ± 0.09 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0339
Residual factor for significantly intense reflections	0.0251
Weighted residual factors for significantly intense reflections	0.0424
Weighted residual factors for all reflections included in the refinement	0.045
Goodness-of-fit parameter for all reflections included in the refinement	1.123
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.	2023052.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.	2023052.cif