Crystallography Open Database

Information card for entry 4110736

Preview

Coordinates	4110736.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Uran-lithium
Formula	C42 H65 Cl3 Li O2 Si2 U2
Calculated formula	C42 H65 Cl3 Li O2 Si2 U2
Title of publication	Unique σ-Bond Metathesis of Silylalkynes Promoted by an ansa-Dimethylsilyl and Oxo-Bridged Uranium Metallocene
Authors of publication	Jiaxi Wang; Ylia Gurevich; Mark Botoshansky; Moris S. Eisen
Journal of publication	Journal of the American Chemical Society
Year of publication	2006
Journal volume	128
Pages of publication	9350 - 9351
a	15.052 ± 0.003 Å
b	10.636 ± 0.002 Å
c	28.982 ± 0.006 Å
α	90°
β	97.33 ± 0.03°
γ	90°
Cell volume	4601.9 ± 1.6 Å³
Cell temperature	230 ± 1 K
Ambient diffraction temperature	230 ± 1 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1677
Residual factor for significantly intense reflections	0.065
Weighted residual factors for significantly intense reflections	0.1167
Weighted residual factors for all reflections included in the refinement	0.1513
Goodness-of-fit parameter for all reflections included in the refinement	0.944
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178878 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/07.	4110736.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4110736.cif
59558	2012-06-12	cif/ Adding structures of 4110736 via cif-deposit CGI script.	4110736.cif