Crystallography Open Database

Information card for entry 4116098

Preview

Coordinates	4116098.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H20 Au N S
Calculated formula	C14 H20 Au N S
Title of publication	Formation of a Novel Luminescent Form of Gold(I) Phenylthiolate via Self-Assembly and Decomposition of Isonitrilegold(I) Phenylthiolate Complexes
Authors of publication	Robert E. Bachman; Sheri A. Bodolosky-Bettis; Shana C. Glennon; Scott A. Sirchio
Journal of publication	Journal of the American Chemical Society
Year of publication	2000
Journal volume	122
Pages of publication	7146 - 7147
a	5.4405 ± 0.0004 Å
b	7.5603 ± 0.0005 Å
c	18.7189 ± 0.0012 Å
α	87.657 ± 0.001°
β	87.101 ± 0.001°
γ	70.421 ± 0.001°
Cell volume	724.26 ± 0.09 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0429
Residual factor for significantly intense reflections	0.0324
Weighted residual factors for significantly intense reflections	0.0674
Weighted residual factors for all reflections included in the refinement	0.0686
Goodness-of-fit parameter for all reflections included in the refinement	0.865
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
178931 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/60.	4116098.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4116098.cif
70675	2013-01-03	cif/ Adding structures of 4116098 via cif-deposit CGI script.	4116098.cif