Crystallography Open Database

Information card for entry 4101343

Preview

Coordinates	4101343.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H44 I2 N2 O P2 U
Calculated formula	C18 H14 I2 N2 O P2 U
Title of publication	Synthesis and reactivity of the imido analogues of the uranyl ion.
Authors of publication	Hayton, Trevor W; Boncella, James M; Scott, Brian L; Batista, Enrique R; Hay, P Jeffrey
Journal of publication	Journal of the American Chemical Society
Year of publication	2006
Journal volume	128
Journal issue	32
Pages of publication	10549 - 10559
a	23.516 ± 0.003 Å
b	23.516 Å
c	10.6177 ± 0.0014 Å
α	90°
β	90°
γ	90°
Cell volume	5871.7 ± 1.1 Å³
Cell temperature	203 ± 2 K
Ambient diffraction temperature	203 ± 2 K
Number of distinct elements	7
Space group number	114
Hermann-Mauguin space group symbol	P -4 21 c
Hall space group symbol	P -4 2n
Residual factor for all reflections	0.0449
Residual factor for significantly intense reflections	0.0344
Weighted residual factors for significantly intense reflections	0.0753
Weighted residual factors for all reflections included in the refinement	0.0773
Goodness-of-fit parameter for all reflections included in the refinement	1.595
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
178759 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/13.	4101343.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4101343.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4101343.cif
966	2010-01-30	cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated.	4101343.cif
396	2008-06-20	Adding new CIF files from J-Am-Chem-Soc-2006/.	4101343.cif