Crystallography Open Database

Information card for entry 4349145

Preview

Coordinates	4349145.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H20 K O P S
Calculated formula	C17 H20 K O P S
Title of publication	Potassium-Mediated Hydrophosphorylation of Heterocumulenes with Diarylphosphane Oxide and Sulfide.
Authors of publication	Härling, Stephan M; Görls, Helmar; Krieck, Sven; Westerhausen, Matthias
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	20
Pages of publication	10741 - 10750
a	17.3948 ± 0.0003 Å
b	16.304 ± 0.0004 Å
c	6.1603 ± 0.0001 Å
α	90°
β	90°
γ	90°
Cell volume	1747.09 ± 0.06 Å³
Cell temperature	133 ± 2 K
Ambient diffraction temperature	133 ± 2 K
Number of distinct elements	6
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0271
Residual factor for significantly intense reflections	0.0258
Weighted residual factors for significantly intense reflections	0.0546
Weighted residual factors for all reflections included in the refinement	0.0553
Goodness-of-fit parameter for all reflections included in the refinement	1.064
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4349145.html