Crystallography Open Database

Information card for entry 4070539

Preview

Coordinates	4070539.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H48 Fe N2 Si2 U
Calculated formula	C36 H48 Fe N2 Si2 U
Title of publication	A Weak Interaction between Iron and Uranium in Uranium Alkyl Complexes Supported by Ferrocene Diamide Ligands
Authors of publication	Monreal, Marisa J.; Diaconescu, Paula L.
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	8
Pages of publication	1702
a	12.316 ± 0.002 Å
b	13.413 ± 0.003 Å
c	22.081 ± 0.004 Å
α	90°
β	95.153 ± 0.002°
γ	90°
Cell volume	3632.9 ± 1.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.1018
Residual factor for significantly intense reflections	0.0895
Weighted residual factors for significantly intense reflections	0.2026
Weighted residual factors for all reflections included in the refinement	0.2096
Goodness-of-fit parameter for all reflections included in the refinement	1.126
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
178594 (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 4/07/05.	4070539.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4070539.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4070539.cif
42547	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4070537, 4070538, 4070539 via cif-deposit CGI script.	4070539.cif