Crystallography Open Database

Information card for entry 7706181

Preview

Coordinates	7706181.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33.94 H32 N4 O4 U
Calculated formula	C34 H32 N4 O4 U
Title of publication	Systematic comparison of the structure of homoleptic tetradentate N<sub>2</sub>O<sub>2</sub>-type Schiff base complexes of tetravalent f-elements (M(IV) = Ce, Th, U, Np, and Pu) in solid state and in solution.
Authors of publication	Radoske, Thomas; Kloditz, Roger; Fichter, Sebastian; März, Juliane; Kaden, Peter; Patzschke, Michael; Schmidt, Moritz; Stumpf, Thorsten; Walter, Olaf; Ikeda-Ohno, Atsushi
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	48
Pages of publication	17559 - 17570
a	14.6015 ± 0.0007 Å
b	14.6038 ± 0.0008 Å
c	13.9168 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	2967.6 ± 0.3 Å³
Cell temperature	106 ± 2 K
Ambient diffraction temperature	105.87 K
Number of distinct elements	5
Space group number	50
Hermann-Mauguin space group symbol	P b a n :2
Hall space group symbol	-P 2ab 2b
Residual factor for all reflections	0.0337
Residual factor for significantly intense reflections	0.0251
Weighted residual factors for significantly intense reflections	0.048
Weighted residual factors for all reflections included in the refinement	0.0547
Goodness-of-fit parameter for all reflections included in the refinement	1.243
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
260105 (current)	2020-12-23	cif/ Adding structures of 7706181, 7706182, 7706183, 7706184, 7706185, 7706186 via cif-deposit CGI script.	7706181.cif