Crystallography Open Database

Information card for entry 7045023

Preview

Coordinates	7045023.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H37 Gd2 N4 Ni2 O27
Calculated formula	C36 H37 Gd2 N4 Ni2 O27
Title of publication	Ni<sup>II</sup>-Ln<sup>III</sup> complexes with o-vanillin as the main ligand: syntheses, structures, magnetic and magnetocaloric properties.
Authors of publication	Costes, Jean-Pierre; Dahan, Françoise; Vendier, Laure; Shova, Sergiu; Lorusso, Giulia; Evangelisti, Marco
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	4
Pages of publication	1106 - 1116
a	10.7627 ± 0.0005 Å
b	11.1417 ± 0.0005 Å
c	12.7244 ± 0.0006 Å
α	73.703 ± 0.002°
β	66.381 ± 0.002°
γ	64.462 ± 0.002°
Cell volume	1250.65 ± 0.1 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 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	0.0671
Residual factor for significantly intense reflections	0.0505
Weighted residual factors for significantly intense reflections	0.139
Weighted residual factors for all reflections included in the refinement	0.173
Goodness-of-fit parameter for all reflections included in the refinement	1.188
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
229534 (current)	2019-11-17	cif/ Updating files of 7045020, 7045021, 7045022, 7045023, 7045024, 7045025 Original log message: Adding full bibliography for 7045020--7045025.cif.	7045023.cif
204177	2017-12-12	cif/ Adding structures of 7045020, 7045021, 7045022, 7045023, 7045024, 7045025 via cif-deposit CGI script.	7045023.cif