Crystallography Open Database

Information card for entry 4333889

Preview

Coordinates	4333889.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H16 Cl N3 O6 U
Calculated formula	C27 H16 Cl N3 O6 U
Title of publication	Synthesis, Structures, and Luminescent Properties of Uranyl Terpyridine Aromatic Carboxylate Coordination Polymers
Authors of publication	Sonia G. Thangavelu; Michael B. Andrews; Simon J.A. Pope; Christopher L. Cahill
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	2060 - 2069
a	10.6869 ± 0.0013 Å
b	8.3588 ± 0.0009 Å
c	26.656 ± 0.004 Å
α	90°
β	92.075 ± 0.004°
γ	90°
Cell volume	2379.6 ± 0.5 Å³
Cell temperature	300 ± 2 K
Ambient diffraction temperature	300 ± 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	0.0606
Residual factor for significantly intense reflections	0.0421
Weighted residual factors for significantly intense reflections	0.1025
Weighted residual factors for all reflections included in the refinement	0.1329
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
179441 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/38.	4333889.cif
99697	2014-02-03	cif/ Adding structures of 4333889 via cif-deposit CGI script.	4333889.cif