Crystallography Open Database

Information card for entry 7112553

Preview

Coordinates	7112553.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21.5 H23.5 K N3.5 O4 U
Calculated formula	C21.5 H23.5 K N3.5 O4 U
Title of publication	New polynuclear U(IV)-U(V) complexes from U(IV) mediated uranyl(V) disproportionation.
Authors of publication	Mougel, Victor; Pécaut, Jacques; Mazzanti, Marinella
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2012
Journal volume	48
Journal issue	6
Pages of publication	868 - 870
a	22.925 ± 0.004 Å
b	14.316 ± 0.003 Å
c	14.0547 ± 0.0019 Å
α	90°
β	101.946 ± 0.015°
γ	90°
Cell volume	4512.8 ± 1.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
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	0.172
Residual factor for significantly intense reflections	0.0932
Weighted residual factors for significantly intense reflections	0.1986
Weighted residual factors for all reflections included in the refinement	0.2419
Goodness-of-fit parameter for all reflections included in the refinement	0.987
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7112553.cif
110817	2014-04-20	cif/ Adding structures of 7112553, 7112554, 7112555, 7112556 via cif-deposit CGI script.	7112553.cif