Crystallography Open Database

Information card for entry 4078232

Preview

Coordinates	4078232.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H35 F Li O10 P Si2 W
Calculated formula	C20 H35 F Li O10 P Si2 W
Title of publication	SET Oxidation of Li/X Phosphinidenoid Complexes by TEMPO
Authors of publication	Nesterov, Vitaly; Schwieger, Sebastian; Schnakenburg, Gregor; Grimme, Stefan; Streubel, Rainer
Journal of publication	Organometallics
Year of publication	2012
Journal volume	31
Journal issue	9
Pages of publication	3457
a	10.1458 ± 0.0009 Å
b	16.7946 ± 0.0015 Å
c	17.6451 ± 0.0015 Å
α	91.249 ± 0.002°
β	93.49 ± 0.002°
γ	92.907 ± 0.002°
Cell volume	2996.3 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0526
Residual factor for significantly intense reflections	0.0494
Weighted residual factors for significantly intense reflections	0.1329
Weighted residual factors for all reflections included in the refinement	0.1363
Goodness-of-fit parameter for all reflections included in the refinement	1.088
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
178671 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/82.	4078232.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4078232.cif
59861	2012-06-14	cif/ Adding structures of 4078232, 4078233 via cif-deposit CGI script.	4078232.cif