Crystallography Open Database

Information card for entry 4304873

Preview

Coordinates	4304873.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[Au(C(NHCH3)2)2]AsF6.0.5benzene
Formula	C9 H19 As Au F6 N4
Calculated formula	C9 H19 As Au F6 N4
Title of publication	Blue or Green Glowing Crystals of the Cation [Au{C(NHMe)2}2]+. Structural Effects of Anions, Hydrogen Bonding, and Solvate Molecules on the Luminescence of a Two-Coordinate Gold(I) Carbene Complex
Authors of publication	Daniel Rios; David M. Pham; James C. Fettinger; Marilyn M. Olmstead; Alan L. Balch
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	3442 - 3451
a	15.956 ± 0.0003 Å
b	15.956 ± 0.0003 Å
c	6.3742 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	1622.83 ± 0.07 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 2 K
Number of distinct elements	6
Space group number	136
Hermann-Mauguin space group symbol	P 42/m n m
Hall space group symbol	-P 4n 2n
Residual factor for all reflections	0.0201
Residual factor for significantly intense reflections	0.0174
Weighted residual factors for significantly intense reflections	0.0359
Weighted residual factors for all reflections included in the refinement	0.0372
Goodness-of-fit parameter for all reflections included in the refinement	1.147
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
179086 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/48.	4304873.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4304873.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4304873.cif
1163	2010-05-11	cif/4/: committing data from the Inorg-Chem-2008_01-12/ deposition.	4304873.cif