Crystallography Open Database

Information card for entry 1568778

Preview

Coordinates	1568778.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C81 H189 Au13 Cl10 Ga5 P9
Calculated formula	C81 H189 Au13 Cl10 Ga5 P9
Title of publication	Synthesis and characterisation of four bimetallic gold–gallium clusters with Au–Ga rings as a new structural motif in gold cluster chemistry
Authors of publication	Strienz, Markus; Fetzer, Florian; Schnepf, Andreas
Journal of publication	Chemical Science
Year of publication	2023
Journal volume	14
Journal issue	17
Pages of publication	4571 - 4579
a	16.1624 ± 0.0005 Å
b	27.8938 ± 0.0008 Å
c	28.6686 ± 0.001 Å
α	90°
β	94.586 ± 0.001°
γ	90°
Cell volume	12883.3 ± 0.7 Å³
Cell temperature	200 K
Ambient diffraction temperature	200 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	0.0619
Residual factor for significantly intense reflections	0.0338
Weighted residual factors for significantly intense reflections	0.0637
Weighted residual factors for all reflections included in the refinement	0.0771
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation probe	x-ray
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
283146 (current)	2023-05-05	cif/ Updating files of 1568775, 1568776, 1568777, 1568778 Original log message: Adding full bibliography for 1568775--1568778.cif.	1568778.cif
282223	2023-04-04	cif/ Adding structures of 1568775, 1568776, 1568777, 1568778 via cif-deposit CGI script.	1568778.cif