Crystallography Open Database

Information card for entry 4337280

Preview

Coordinates	4337280.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C74 H108 Cu2 Gd2 N4 O18
Calculated formula	C74 H100 Cu2 Gd2 N4 O18
Title of publication	Synthesis, structural characterization, and magnetic properties of a copper-gadolinium complex derived from a hydroxybenzohydrazide ligand.
Authors of publication	Costes, Jean-Pierre; Duhayon, Carine; Vendier, Laure
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	4
Pages of publication	2181 - 2187
a	20.873 ± 0.0011 Å
b	17.923 ± 0.003 Å
c	26.037 ± 0.0015 Å
α	90°
β	112.462 ± 0.005°
γ	90°
Cell volume	9001.6 ± 1.7 Å³
Cell temperature	180 K
Ambient diffraction temperature	180 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1351
Residual factor for significantly intense reflections	0.0716
Weighted residual factors for all reflections	0.1062
Weighted residual factors for significantly intense reflections	0.0795
Weighted residual factors for all reflections included in the refinement	0.0694
Goodness-of-fit parameter for all reflections included in the refinement	1.1365
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
179475 (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 4/33/72.	4337280.cif
106255	2014-03-15	cif/ Adding structures of 4337278, 4337279, 4337280 via cif-deposit CGI script.	4337280.cif