Crystallography Open Database

Information card for entry 4001106

Preview

Coordinates	4001106.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H23 F4 N4 O12 P3 U2
Calculated formula	C6 H18 F4 N3.99 O12 P3 U2
Title of publication	The First Organically Templated Tetravalent Uranium Phosphates with Dimer-Structured Topologies
Authors of publication	Lai, Yu-Lun; Chiang, Ray-Kuang; Lii, Kwang-Hwa; Wang, Sue-Lein
Journal of publication	Chemistry of Materials
Year of publication	2008
Journal volume	20
Journal issue	2
Pages of publication	523
a	11.1124 ± 0.0004 Å
b	19.683 ± 0.0008 Å
c	10.1466 ± 0.0004 Å
α	90°
β	114.362 ± 0.001°
γ	90°
Cell volume	2021.71 ± 0.14 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	7
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	0.0328
Residual factor for significantly intense reflections	0.0271
Weighted residual factors for significantly intense reflections	0.0606
Weighted residual factors for all reflections included in the refinement	0.0629
Goodness-of-fit parameter for all reflections included in the refinement	0.918
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
178377 (current)	2016-03-21	cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00.	4001106.cif
120073	2014-07-11	Adding DOIs to range 4/00 structures.	4001106.cif
41855	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4001105, 4001106, 4001107, 4001108 via cif-deposit CGI script.	4001106.cif