Crystallography Open Database

Information card for entry 7044982

Preview

Coordinates	7044982.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C92 H116 Gd4 O32
Calculated formula	C92 H108 Gd4 O32
Title of publication	Effect of coordination geometry on the magnetic properties of a series of Ln<sub>2</sub> and Ln<sub>4</sub> hydroxo clusters.
Authors of publication	Rasamsetty, Amaleswari; Das, Chinmoy; Sañudo, E Carolina; Shanmugam, Maheswaran; Baskar, Viswanathan
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	5
Pages of publication	1726 - 1738
a	25.191 ± 0.004 Å
b	14.292 ± 0.003 Å
c	27.482 ± 0.005 Å
α	90°
β	101.401 ± 0.003°
γ	90°
Cell volume	9699 ± 3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.043
Residual factor for significantly intense reflections	0.0366
Weighted residual factors for significantly intense reflections	0.0887
Weighted residual factors for all reflections included in the refinement	0.0923
Goodness-of-fit parameter for all reflections included in the refinement	1.04
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
229460 (current)	2019-11-17	cif/ Updating files of 7044982, 7044983, 7044984, 7044985, 7044986, 7044987 Original log message: Adding full bibliography for 7044982--7044987.cif.	7044982.cif
204062	2017-12-08	cif/ Adding structures of 7044982, 7044983, 7044984, 7044985, 7044986, 7044987 via cif-deposit CGI script.	7044982.cif