Crystallography Open Database

Information card for entry 4327339

Preview

Coordinates	4327339.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	4
Formula	C21 H22 Au2 B2 F8 N6 O0.5
Calculated formula	C20.25 H22 Au2 B2 F8 N6 O0.25
Title of publication	Mono-, Di-, and Trinuclear Luminescent Silver(I) and Gold(I) N-Heterocyclic Carbene Complexes Derived from the Picolyl-Substituted Methylimidazolium Salt: 1-Methyl-3-(2-pyridinylmethyl)-1H-imidazolium Tetrafluoroborate
Authors of publication	Vincent J. Catalano; Adam L. Moore
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	6558 - 6566
a	21.2362 ± 0.0006 Å
b	12.1942 ± 0.0003 Å
c	21.2244 ± 0.0006 Å
α	90°
β	109.89 ± 0.001°
γ	90°
Cell volume	5168.4 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0714
Residual factor for significantly intense reflections	0.0661
Weighted residual factors for significantly intense reflections	0.1679
Weighted residual factors for all reflections included in the refinement	0.1725
Goodness-of-fit parameter for all reflections included in the refinement	1.067
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4327339.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4327339.cif
61103	2012-06-21	cif/ Adding structures of 4327339 via cif-deposit CGI script.	4327339.cif