Crystallography Open Database

Information card for entry 1571085

Preview

Coordinates	1571085.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H85 Au2 B2 F6 N O4 P2 S2
Calculated formula	C56 H85 Au2 B2 F6 N O4 P2 S2
Title of publication	Chemo-selective Stille-type coupling of acyl-chlorides upon phosphine-borane Au(i) catalysis.
Authors of publication	Hidalgo, Nereida; Le Gac, Arnaud; Mallet-Ladeira, Sonia; Bouhadir, Ghenwa; Bourissou, Didier
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	14
Pages of publication	5187 - 5191
a	10.8707 ± 0.0011 Å
b	11.6793 ± 0.0012 Å
c	48.43 ± 0.005 Å
α	89.013 ± 0.002°
β	86.081 ± 0.002°
γ	85.987 ± 0.002°
Cell volume	6118.9 ± 1.1 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	9
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1192
Residual factor for significantly intense reflections	0.0566
Weighted residual factors for significantly intense reflections	0.0973
Weighted residual factors for all reflections included in the refinement	0.1203
Goodness-of-fit parameter for all reflections included in the refinement	1.02
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1571085.html