Crystallography Open Database

Information card for entry 4084064

Preview

Coordinates	4084064.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H23 Au Cl O P
Calculated formula	C12 H23 Au Cl O P
SMILES	[Au](Cl)[P](O)(C1CCCCC1)C1CCCCC1
Title of publication	Secondary Phosphine Oxide‒Gold(I) Complexes and Their First Application in Catalysis
Authors of publication	Schröder, Felix; Tugny, Coralie; Salanouve, Elise; Clavier, Hervé; Giordano, Laurent; Moraleda, Delphine; Gimbert, Yves; Mouriès-Mansuy, Virginie; Goddard, Jean-Philippe; Fensterbank, Louis
Journal of publication	Organometallics
Year of publication	2014
Journal volume	33
Journal issue	15
Pages of publication	4051
a	9.6536 ± 0.0002 Å
b	9.8246 ± 0.0002 Å
c	16.8039 ± 0.0004 Å
α	101.016 ± 0.001°
β	106.454 ± 0.001°
γ	97.442 ± 0.001°
Cell volume	1471.47 ± 0.06 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 1 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0208
Residual factor for significantly intense reflections	0.0188
Weighted residual factors for significantly intense reflections	0.0469
Weighted residual factors for all reflections included in the refinement	0.0481
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
178729 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/40.	4084064.cif
123081	2014-09-06	cif/ Updating files of 4084063, 4084064, 4084065, 4084066, 4084067 Original log message: Adding full bibliography for 4084063--4084067.cif.	4084064.cif
120703	2014-07-24	cif/ Adding structures of 4084063, 4084064, 4084065, 4084066, 4084067 via cif-deposit CGI script.	4084064.cif