Crystallography Open Database

Information card for entry 4063451

Preview

Coordinates	4063451.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21.73 H27.45 Au Cl4.45 N2
Calculated formula	C21.728 H27.456 Au Cl4.456 N2
Title of publication	Synthetic and Structural Studies of [AuCl3(NHC)] Complexes
Authors of publication	Gaillard, Sylvain; Slawin, Alexandra M. Z.; Bonura, Allen T.; Stevens, Edwin D.; Nolan, Steven P.
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	2
Pages of publication	394
a	8.419 ± 0.0003 Å
b	15.8293 ± 0.0005 Å
c	19.2834 ± 0.0006 Å
α	90°
β	94.75 ± 0.001°
γ	90°
Cell volume	2561.01 ± 0.15 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0649
Residual factor for significantly intense reflections	0.0627
Weighted residual factors for significantly intense reflections	0.1581
Weighted residual factors for all reflections included in the refinement	0.159
Goodness-of-fit parameter for all reflections included in the refinement	1.13
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
178529 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/34.	4063451.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4063451.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4063451.cif
19491	2011-05-11	../uploads/cif-deposit/cod/cif Adding structures of 4063442, 4063443, 4063444, 4063445, 4063446, 4063447, 4063448, 4063449, 4063450, 4063451, 4063452 via cif-deposit CGI script.	4063451.cif