Crystallography Open Database

Information card for entry 4515748

Preview

Coordinates	4515748.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	N-(2,4,6-trimethyl-phenyl)-2-dicyclohexylphosphinylchlorogold(i)- pyridinium hexafluoroantimonate
Formula	C26 H37 Au Cl F6 N P Sb
Calculated formula	C26 H37 Au Cl F6 N P Sb
Title of publication	N-Arylpyridiniophosphines: Synthesis, Structure, and Applications in Au(I) Catalysis
Authors of publication	Tinnermann, Hendrik; Nicholls, Leo D. M.; Johannsen, Tim; Wille, Christian; Golz, Christopher; Goddard, Richard; Alcarazo, Manuel
Journal of publication	ACS Catalysis
Year of publication	2018
Journal volume	8
Journal issue	11
Pages of publication	10457
a	10.6409 ± 0.0009 Å
b	16.737 ± 0.002 Å
c	17.0626 ± 0.0014 Å
α	82.428 ± 0.008°
β	84.084 ± 0.005°
γ	87.346 ± 0.009°
Cell volume	2994.6 ± 0.5 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0899
Residual factor for significantly intense reflections	0.0587
Weighted residual factors for significantly intense reflections	0.1377
Weighted residual factors for all reflections included in the refinement	0.1562
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
225873 (current)	2019-11-10	cif/ Adding structures of 4515748 via cif-deposit CGI script.	4515748.cif