Crystallography Open Database

Information card for entry 4336655

Preview

Coordinates	4336655.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H2 Co2 O8
Calculated formula	C10 H2 Co2 O8
Title of publication	Neutron Diffraction Studies of the Molecular Compound [Co2(bta)]n (H4bta =1,2,4,5-Benzenetetracarboxylic Acid): In the Quest of Canted Ferromagnetism
Authors of publication	Oscar Fabelo; Laura Cañadillas-Delgado; Jorge Pasán; Pau Díaz-Gallifa; Catalina Ruiz-Pérez; Francesc Lloret; Miguel Julve; Inés Puente Orench; Javier Campo; Juan Rodríguez-Carvajal
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	12818 - 12827
a	6.1453 ± 0.0005 Å
b	17.465 ± 0.0009 Å
c	4.5525 ± 0.0005 Å
α	90°
β	115.763 ± 0.005°
γ	90°
Cell volume	440.04 ± 0.07 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.039
Residual factor for significantly intense reflections	0.0338
Weighted residual factors for significantly intense reflections	0.0869
Weighted residual factors for all reflections included in the refinement	0.0909
Goodness-of-fit parameter for all reflections included in the refinement	1.173
Diffraction radiation probe	x-ray
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
179469 (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 4/33/66.	4336655.cif
102662	2014-02-21	cif/ Adding structures of 4336655 via cif-deposit CGI script.	4336655.cif