Crystallography Open Database

Information card for entry 7250491

Preview

Coordinates	7250491.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H20 Au Br2 Cl I2 N8
Calculated formula	C23 H20 Au Br2 Cl I2 N8
Title of publication	Gold(i) and gold(iii) complexes of triazolyl-functionalised NHCs
Authors of publication	Al-Buthabhak, Hawraa S.; Al-Ameed, Karrar; Yu, Yu; Sobolev, Alexandre N.; Moggach, Stephen A.; Al-Salami, Hani; Ferro, Vito; Baker, Murray V.
Journal of publication	RSC Advances
Year of publication	2025
Journal volume	15
Journal issue	23
Pages of publication	18123 - 18141
a	11.5821 ± 0.0002 Å
b	13.4019 ± 0.0002 Å
c	20.1568 ± 0.0003 Å
α	104.821 ± 0.001°
β	102.945 ± 0.001°
γ	99.131 ± 0.001°
Cell volume	2869.3 ± 0.08 Å³
Cell temperature	99.9 ± 0.3 K
Ambient diffraction temperature	99.9 ± 0.3 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0748
Residual factor for significantly intense reflections	0.0675
Weighted residual factors for significantly intense reflections	0.1651
Weighted residual factors for all reflections included in the refinement	0.1706
Goodness-of-fit parameter for all reflections included in the refinement	1.02
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
299886 (current)	2025-05-31	cif/ Adding structures of 7250488, 7250489, 7250490, 7250491 via cif-deposit CGI script.	7250491.cif