Crystallography Open Database

Information card for entry 4335291

Preview

Coordinates	4335291.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H90 N2 O4 U
Calculated formula	C60 H90 N2 O4 U
Title of publication	"Oxidative Addition" of Halogens to Uranium(IV) Bis(amidophenolate) Complexes
Authors of publication	Ellen M. Matson; Stacey R. Opperwall; Phillip E. Fanwick; Suzanne C. Bart
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	7295 - 7304
a	12.1917 ± 0.0003 Å
b	15.9335 ± 0.0008 Å
c	18.8033 ± 0.0007 Å
α	109.55 ± 0.003°
β	91.957 ± 0.002°
γ	102.413 ± 0.003°
Cell volume	3339.2 ± 0.2 Å³
Cell temperature	150 ± 0.02 K
Ambient diffraction temperature	150 ± 0.02 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.037
Residual factor for significantly intense reflections	0.036
Weighted residual factors for significantly intense reflections	0.097
Weighted residual factors for all reflections included in the refinement	0.099
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CU-Kα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4335291.cif
101200	2014-02-10	cif/ Adding structures of 4335291 via cif-deposit CGI script.	4335291.cif