Crystallography Open Database

Information card for entry 4326082

Preview

Coordinates	4326082.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H8 N2 O17 U2
Calculated formula	C16 H8 N2 O17 U2
Title of publication	Three-Dimensional Hybrid Framework Containing U2O13 Dimers Connected via Cation-Cation Interactions
Authors of publication	Rachel C. Severance; Mark D. Smith; Hans-Conrad zur Loye
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	7931 - 7933
a	11.697 ± 0.0007 Å
b	15.1449 ± 0.0009 Å
c	12.2564 ± 0.0008 Å
α	90°
β	109.193 ± 0.001°
γ	90°
Cell volume	2050.5 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0416
Residual factor for significantly intense reflections	0.0306
Weighted residual factors for significantly intense reflections	0.0611
Weighted residual factors for all reflections included in the refinement	0.0652
Goodness-of-fit parameter for all reflections included in the refinement	1.032
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
179363 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/60.	4326082.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4326082.cif
47123	2012-03-22	../uploads/cif-deposit/cod/cif Adding structures of 4326082 via cif-deposit CGI script.	4326082.cif