Crystallography Open Database

Information card for entry 7210416

Preview

Coordinates	7210416.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H28 N4 Ni O19 U2
Calculated formula	C32 H28 N4 Ni O19 U2
Title of publication	Uranyl‒3d block metal ion heterometallic carboxylate complexes including additional chelating nitrogen donors
Authors of publication	Thuéry, Pierre
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	33
Pages of publication	6533
a	11.7697 ± 0.0008 Å
b	12.6971 ± 0.001 Å
c	15.9821 ± 0.0007 Å
α	86.772 ± 0.005°
β	79.231 ± 0.005°
γ	63.746 ± 0.004°
Cell volume	2103.3 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.072
Residual factor for significantly intense reflections	0.0393
Weighted residual factors for significantly intense reflections	0.0874
Weighted residual factors for all reflections included in the refinement	0.0944
Goodness-of-fit parameter for all reflections included in the refinement	0.915
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
180435 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/04.	7210416.cif
87619	2013-08-27	cif/ Adding structures of 7210411, 7210412, 7210413, 7210414, 7210415, 7210416, 7210417, 7210418 via cif-deposit CGI script.	7210416.cif