Crystallography Open Database

Information card for entry 7715927

Preview

Coordinates	7715927.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H38 I3 N4 O5 U
Calculated formula	C20 H38 I3 N4 O5 U
Title of publication	Comparison of the structural, electrochemical, and spectroscopic properties of two cryptates of trivalent uranium.
Authors of publication	Kulasekara, D. Nuwangi; Bailey, Matthew D.; Ward, Cassandra L.; Allen, Matthew J.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	20
Pages of publication	8657 - 8661
a	13.9235 ± 0.0004 Å
b	14.4448 ± 0.0003 Å
c	30.0718 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	6048.1 ± 0.3 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	73
Hermann-Mauguin space group symbol	I b c a
Hall space group symbol	-I 2b 2c
Residual factor for all reflections	0.0321
Residual factor for significantly intense reflections	0.0254
Weighted residual factors for significantly intense reflections	0.0594
Weighted residual factors for all reflections included in the refinement	0.0635
Goodness-of-fit parameter for all reflections included in the refinement	1.03
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
293088 (current)	2024-07-05	cif/ Updating files of 7715927, 7715928, 7715929 Original log message: Adding full bibliography for 7715927--7715929.cif.	7715927.cif
291465	2024-05-03	cif/ Adding structures of 7715927, 7715928, 7715929 via cif-deposit CGI script.	7715927.cif