Crystallography Open Database

Information card for entry 7036013

Preview

Coordinates	7036013.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H10 Au N2 S8
Calculated formula	C10 H10 Au N2 S8
SMILES	[Au]12(Sc3sc(SCC)nc3S1)Sc1c(S2)sc(SCC)n1
Title of publication	Gold dithiolene complexes: easy access to 2-alkylthio-thiazoledithiolate complexes.
Authors of publication	Filatre-Furcate, Agathe; Auban-Senzier, Pascale; Fourmigué, Marc; Roisnel, Thierry; Dorcet, Vincent; Lorcy, Dominique
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	35
Pages of publication	15683 - 15689
a	7.5056 ± 0.0004 Å
b	7.9184 ± 0.0004 Å
c	15.1842 ± 0.0008 Å
α	89.02 ± 0.002°
β	87.077 ± 0.002°
γ	66.212 ± 0.002°
Cell volume	824.69 ± 0.08 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.0386
Residual factor for significantly intense reflections	0.0322
Weighted residual factors for significantly intense reflections	0.087
Weighted residual factors for all reflections included in the refinement	0.0933
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation probe	x-ray
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
161345 (current)	2015-10-09	cif/ Updating files of 7036011, 7036012, 7036013 Original log message: Adding full bibliography for 7036011--7036013.cif.	7036013.cif
152654	2015-07-31	cif/ Adding structures of 7036011, 7036012, 7036013 via cif-deposit CGI script.	7036013.cif