Crystallography Open Database

Information card for entry 4510663

Preview

Coordinates	4510663.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H27 N O28 U4
Calculated formula	C33 H27 N O28 U4
Title of publication	Mixed Formate-Dicarboxylate Coordination Polymers with Tetravalent Uranium: Occurrence of Tetranuclear {U4O4} and Hexanuclear {U6O4(OH)4} Motifs
Authors of publication	Falaise, Clément; Volkringer, Christophe; Loiseau, Thierry
Journal of publication	Crystal Growth & Design
Year of publication	2013
Journal volume	13
Journal issue	7
Pages of publication	3225
a	17.8701 ± 0.0005 Å
b	13.8872 ± 0.0004 Å
c	18.4391 ± 0.0005 Å
α	90°
β	92.262 ± 0.002°
γ	90°
Cell volume	4572.4 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0499
Residual factor for significantly intense reflections	0.0292
Weighted residual factors for significantly intense reflections	0.0507
Weighted residual factors for all reflections included in the refinement	0.056
Goodness-of-fit parameter for all reflections included in the refinement	1
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
179653 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/06.	4510663.cif
113115	2014-05-08	cif/ Adding structures of 4510663 via cif-deposit CGI script.	4510663.cif