Crystallography Open Database

Information card for entry 7246590

Preview

Coordinates	7246590.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H10 Au Cl N2
Calculated formula	C6 H10 Au Cl N2
SMILES	[Au](Cl)=C1N(CC)C=CN1C
Title of publication	Reactions of noble-metal oxides in ionic liquids near room temperature
Authors of publication	Liebertseder, Mareike; Donsbach, Carsten; Feldmann, Claus
Journal of publication	RSC Advances
Year of publication	2023
Journal volume	13
Journal issue	17
Pages of publication	11441 - 11449
a	8.8428 ± 0.0008 Å
b	9.302 ± 0.0008 Å
c	10.6838 ± 0.0009 Å
α	89.565 ± 0.007°
β	87.391 ± 0.007°
γ	82.121 ± 0.007°
Cell volume	869.6 ± 0.13 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0521
Residual factor for significantly intense reflections	0.0494
Weighted residual factors for significantly intense reflections	0.1385
Weighted residual factors for all reflections included in the refinement	0.1408
Goodness-of-fit parameter for all reflections included in the refinement	1.088
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
295862 (current)	2024-11-09	cif/7: Fixing Z values and formulae	7246590.cif
282607	2023-04-12	cif/ Adding structures of 7246589, 7246590, 7246591, 7246592, 7246593, 7246594 via cif-deposit CGI script.	7246590.cif