Crystallography Open Database

Information card for entry 4104617

Preview

Coordinates	4104617.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H19 Au F6 N5 P
Calculated formula	C22 H8 Au F6 N3 P
Title of publication	Luminescent Cyclometalated N-Heterocyclic Carbene-Containing Organogold(III) Complexes: Synthesis, Characterization, Electrochemistry, and Photophysical Studies
Authors of publication	Vonika Ka-Man Au; Keith Man-Chung Wong; Nianyong Zhu; Vivian Wing-Wah Yam
Journal of publication	Journal of the American Chemical Society
Year of publication	2009
Journal volume	131
Pages of publication	9076 - 9085
a	12.22 ± 0.002 Å
b	11.51 ± 0.002 Å
c	15.874 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	2232.7 ± 0.7 Å³
Cell temperature	253 ± 2 K
Ambient diffraction temperature	253 ± 2 K
Number of distinct elements	6
Space group number	57
Hermann-Mauguin space group symbol	P b c m
Hall space group symbol	-P 2c 2b
Residual factor for all reflections	0.0358
Residual factor for significantly intense reflections	0.0317
Weighted residual factors for significantly intense reflections	0.0792
Weighted residual factors for all reflections included in the refinement	0.0808
Goodness-of-fit parameter for all reflections included in the refinement	1.073
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
178792 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/46.	4104617.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4104617.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4104617.cif
29643	2011-11-04	../uploads/cif-deposit/cod/cif Adding structures of 4104617 via cif-deposit CGI script.	4104617.cif