Crystallography Open Database

Information card for entry 4327344

Preview

Coordinates	4327344.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H72 Er2 Fe2 N22 O16
Calculated formula	C62 H52 Er2 Fe2 N22 O16
Title of publication	Magnetism of Cyano-Bridged Ln3±M3+ Complexes. Part II: One-Dimensional Complexes (Ln3+ = Eu, Tb, Dy, Ho, Er, Tm; M3+ = Fe or Co) with bpy as Blocking Ligand
Authors of publication	Albert Figuerola; Joan Ribas; David Casanova; Miguel Maestro; Santiago Alvarez; Carmen Diaz
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	6949 - 6958
a	9.7267 ± 0.0006 Å
b	10.5917 ± 0.0006 Å
c	19.748 ± 0.0012 Å
α	83.205 ± 0.001°
β	84.222 ± 0.001°
γ	63.997 ± 0.001°
Cell volume	1812.97 ± 0.19 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0434
Residual factor for significantly intense reflections	0.0328
Weighted residual factors for significantly intense reflections	0.0846
Weighted residual factors for all reflections included in the refinement	0.1103
Goodness-of-fit parameter for all reflections included in the refinement	1.126
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
179376 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/73.	4327344.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4327344.cif
61108	2012-06-21	cif/ Adding structures of 4327344 via cif-deposit CGI script.	4327344.cif