Crystallography Open Database

Information card for entry 4336406

Preview

Coordinates	4336406.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C3 H3 Ce O6
Calculated formula	C3 H3 Ce O6
Title of publication	Crystal Structure and Solution Species of Ce(III) and Ce(IV) Formates: From Mononuclear to Hexanuclear Complexes
Authors of publication	Christoph Hennig; Atsushi Ikeda-Ohno; Werner Kraus; Stephan Weiss; Philip Pattison; Hermann Emerich; Paula M. Abdala; Andreas C. Scheinost
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	11734 - 11743
a	10.706 ± 0.002 Å
b	10.706 ± 0.002 Å
c	4.1205 ± 0.0012 Å
α	90°
β	90°
γ	120°
Cell volume	409.01 ± 0.16 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	160
Hermann-Mauguin space group symbol	R 3 m :H
Hall space group symbol	R 3 -2"
Residual factor for all reflections	0.0325
Residual factor for significantly intense reflections	0.0325
Weighted residual factors for significantly intense reflections	0.0741
Weighted residual factors for all reflections included in the refinement	0.0741
Goodness-of-fit parameter for all reflections included in the refinement	1.176
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
179467 (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 4/33/64.	4336406.cif
102397	2014-02-20	cif/ Adding structures of 4336406 via cif-deposit CGI script.	4336406.cif