Crystallography Open Database

Information card for entry 4508754

Preview

Coordinates	4508754.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	catena-[(mu-oxalato)(mu-1,2-bis(4-pyridyl)ethane)Iron(II)]
Formula	C14 H12 Fe N2 O4
Calculated formula	C14 H12 Fe N2 O4
Title of publication	Rational Design of 2D Magnetic Metal−Organic Coordination Polymers Assembled from Oxalato and Dipyridyl Spacers
Authors of publication	García-Couceiro, Urko; Castillo, Oscar; Luque, Antonio; García-Terán, Juan P.; Beobide, Garikoitz; Román, Pascual
Journal of publication	Crystal Growth & Design
Year of publication	2006
Journal volume	6
Journal issue	8
Pages of publication	1839
a	9.57 ± 0.001 Å
b	13.777 ± 0.001 Å
c	10.82 ± 0.001 Å
α	90°
β	106.01 ± 0.01°
γ	90°
Cell volume	1371.2 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.1064
Residual factor for significantly intense reflections	0.0525
Weighted residual factors for significantly intense reflections	0.1191
Weighted residual factors for all reflections included in the refinement	0.1366
Goodness-of-fit parameter for all reflections included in the refinement	0.965
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179623 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/87.	4508754.cif
96909	2014-01-29	cif/ Adding structures of 4508752, 4508753, 4508754, 4508755, 4508756, 4508757, 4508758, 4508759 via cif-deposit CGI script.	4508754.cif