Crystallography Open Database

Information card for entry 4105637

Preview

Coordinates	4105637.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H14.67 F N O3.33
Calculated formula	C17 H14 F N O3.33333
Title of publication	A New Family of Cinchona-Derived Amino Phosphine Precatalysts: Application to the Highly Enantio- and Diastereoselective Silver-Catalyzed Isocyanoacetate Aldol Reaction
Authors of publication	Filippo Sladojevich; Andrea Trabocchi; Antonio Guarna; Darren J. Dixon
Journal of publication	Journal of the American Chemical Society
Year of publication	2011
Journal volume	133
Pages of publication	1710 - 1713
a	25.205 ± 0.008 Å
b	25.205 ± 0.008 Å
c	5.987 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	3294 ± 2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	146
Hermann-Mauguin space group symbol	R 3 :H
Hall space group symbol	R 3
Residual factor for all reflections	0.0625
Residual factor for significantly intense reflections	0.0498
Weighted residual factors for significantly intense reflections	0.0937
Weighted residual factors for all reflections included in the refinement	0.0986
Goodness-of-fit parameter for all reflections included in the refinement	1.072
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/4105637.html