Crystallography Open Database

Information card for entry 4308073

Preview

Coordinates	4308073.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H5 Co O5.5 S
Calculated formula	C6 H5 Co O5.5 S
Title of publication	Structure and Magnetic Properties of a New Cobalt(II) Thiophenedicarboxylate Coordination Polymer Showing Unprecedented Coordination
Authors of publication	Aude Demessence; Guillaume Rogez; Richard Welter; Pierre Rabu
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	3423 - 3425
a	19.828 ± 0.0005 Å
b	7.513 ± 0.0002 Å
c	10.73 ± 0.0003 Å
α	90°
β	103.44 ± 0.002°
γ	90°
Cell volume	1554.65 ± 0.07 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0313
Residual factor for significantly intense reflections	0.0258
Weighted residual factors for significantly intense reflections	0.0625
Weighted residual factors for all reflections included in the refinement	0.0649
Goodness-of-fit parameter for all reflections included in the refinement	1.086
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4308073.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4308073.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4308073.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4308073.cif