Crystallography Open Database

Information card for entry 4089524

Preview

Coordinates	4089524.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H16 As O10 P W2
Calculated formula	C16 H16 As O10 P W2
SMILES	[W]([AsH]([W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])[PH](C(C)C)C(C)C)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
Title of publication	Versatile Reactivity of Bridged Pentelidene Complexes toward Secondary and Tertiary Phosphines
Authors of publication	Stubenhofer, Markus; Kuntz, Christian; Bodensteiner, Michael; Timoshkin, Alexey Y.; Scheer, Manfred
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	12
Pages of publication	3521
a	10.4709 ± 0.0001 Å
b	13.8828 ± 0.0002 Å
c	16.3691 ± 0.0002 Å
α	90°
β	92.908 ± 0.001°
γ	90°
Cell volume	2376.44 ± 0.05 Å³
Cell temperature	123 ± 1 K
Ambient diffraction temperature	123 ± 1 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0529
Residual factor for significantly intense reflections	0.048
Weighted residual factors for significantly intense reflections	0.1278
Weighted residual factors for all reflections included in the refinement	0.1315
Goodness-of-fit parameter for all reflections included in the refinement	1.07
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
243667 (current)	2019-11-26	cif/ Adding structures of 4089524 via cif-deposit CGI script.	4089524.cif