Crystallography Open Database

Information card for entry 4333555

Preview

Coordinates	4333555.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[(Mes3P)2Au][Au(CN)2]
Formula	C58 H70 Au2 Cl4 N2 P2
Calculated formula	C58 H70 Au2 Cl4 N2 P2
Title of publication	End-On and Side-On π-Acid Ligand Adducts of Gold(I): Carbonyl, Cyanide, Isocyanide, and Cyclooctyne Gold(I) Complexes Supported by N-Heterocyclic Carbenes and Phosphines
Authors of publication	Mehmet Ali Celik; Chandrakanta Dash; Venkata A. K. Adiraju; Animesh Das; Muhammed Yousufuddin; Gernot Frenking; H. V. Rasika Dias
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	729 - 742
a	12.1018 ± 0.0009 Å
b	28.89 ± 0.002 Å
c	16.0447 ± 0.0012 Å
α	90°
β	90.694 ± 0.001°
γ	90°
Cell volume	5609.2 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 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	0.0757
Residual factor for significantly intense reflections	0.0596
Weighted residual factors for significantly intense reflections	0.13
Weighted residual factors for all reflections included in the refinement	0.1351
Goodness-of-fit parameter for all reflections included in the refinement	1.222
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
179438 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/35.	4333555.cif
99350	2014-01-31	cif/ Adding structures of 4333555 via cif-deposit CGI script.	4333555.cif