Crystallography Open Database

Information card for entry 4080192

Preview

Coordinates	4080192.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H108 N6 Si12 Te U2
Calculated formula	C36 H108 N6 Si12 Te U2
SMILES	[U]([Te][U](N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C
Title of publication	Chalcogen Atom Transfer to Uranium(III): Synthesis and Characterization of [(R2N)3U]2(μ-E) and [(R2N)3U]2(μ-η2:η2-S2) (R = SiMe3; E = S, Se, Te)
Authors of publication	Brown, Jessie L.; Wu, Guang; Hayton, Trevor W.
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	5
Pages of publication	1193
a	32.0769 ± 0.0015 Å
b	11.87 ± 0.0008 Å
c	38.0147 ± 0.0019 Å
α	90°
β	113.205 ± 0.002°
γ	90°
Cell volume	13303.3 ± 1.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0751
Residual factor for significantly intense reflections	0.0482
Weighted residual factors for significantly intense reflections	0.0826
Weighted residual factors for all reflections included in the refinement	0.0891
Goodness-of-fit parameter for all reflections included in the refinement	1.144
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
178690 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/01.	4080192.cif
85872	2013-05-07	cif/ Adding structures of 4080189, 4080190, 4080191, 4080192 via cif-deposit CGI script.	4080192.cif