Crystallography Open Database

Information card for entry 4325512

Preview

Coordinates	4325512.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H53 N14 Nd2 Ni2 O27.5
Calculated formula	C46 H49 N14 Nd2 Ni2 O27.5
Title of publication	Preparation, Crystal Structures, and Magnetic Features for a Series of Dinuclear [NiIILnIII] Schiff-Base Complexes: Evidence for Slow Relaxation of the Magnetization for the DyIII Derivative
Authors of publication	Traian D. Pasatoiu; Jean-Pascal Sutter; Augustin M. Madalan; Fatima Zohra Chiboub Fellah; Carine Duhayon; Marius Andruh
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	5890 - 5898
a	18.4138 ± 0.0005 Å
b	19.6726 ± 0.0003 Å
c	35.2354 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	12763.9 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0945
Residual factor for significantly intense reflections	0.0655
Weighted residual factors for significantly intense reflections	0.1605
Weighted residual factors for all reflections included in the refinement	0.1854
Goodness-of-fit parameter for all reflections included in the refinement	1.047
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
179358 (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 4/32/55.	4325512.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4325512.cif
44582	2012-03-16	../uploads/cif-deposit/cod/cif Adding structures of 4325512 via cif-deposit CGI script.	4325512.cif