Crystallography Open Database

Information card for entry 7701077

Preview

Coordinates	7701077.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H29 Cu N2 O7.5
Calculated formula	C20 H24 Cu N2 O5
Title of publication	The role of 3d-4f exchange interaction in SMM behaviour and magnetic refrigeration of carbonato bridged CuLn (Ln = Dy, Tb and Gd) complexes of an unsymmetrical N<sub>2</sub>O<sub>4</sub> donor ligand.
Authors of publication	Maity, Souvik; Mondal, Arpan; Konar, Sanjit; Ghosh, Ashutosh
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	40
Pages of publication	15170 - 15183
a	10.316 ± 0.007 Å
b	18.602 ± 0.014 Å
c	18.96 ± 0.013 Å
α	82.83 ± 0.02°
β	76.32 ± 0.02°
γ	89.9 ± 0.02°
Cell volume	3506 ± 4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1666
Residual factor for significantly intense reflections	0.086
Weighted residual factors for significantly intense reflections	0.1877
Weighted residual factors for all reflections included in the refinement	0.2281
Goodness-of-fit parameter for all reflections included in the refinement	1.017
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
224257 (current)	2019-11-08	cif/ Updating files of 7701077, 7701078, 7701079, 7701080 Original log message: Adding full bibliography for 7701077--7701080.cif.	7701077.cif
218061	2019-09-07	cif/ Adding structures of 7701077, 7701078, 7701079, 7701080 via cif-deposit CGI script.	7701077.cif