Crystallography Open Database

Information card for entry 2023062

2023061 << 2023062 >> 2023063

Preview

Coordinates	2023062.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Tribromido[di-<i>tert</i>-butyl(propan-2-yl)phosphane selenide-κ<i>S</i>]gold(III)
Formula	C11 H25 Au Br3 P Se
Calculated formula	C11 H25 Au Br3 P Se
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	8.6 ± 0.0005 Å
b	10.2045 ± 0.0007 Å
c	11.5987 ± 0.0007 Å
α	77.475 ± 0.006°
β	69.764 ± 0.006°
γ	72.601 ± 0.006°
Cell volume	904.02 ± 0.11 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	0.0252
Residual factor for significantly intense reflections	0.0196
Weighted residual factors for significantly intense reflections	0.0346
Weighted residual factors for all reflections included in the refinement	0.036
Goodness-of-fit parameter for all reflections included in the refinement	1.049
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.	2023062.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.	2023062.cif