Crystallography Open Database

Information card for entry 7029396

Preview

Coordinates	7029396.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H211 Cu24 Gd6 N24 Na O151
Calculated formula	C48 H74 Cu24 Gd6 N24 Na O151
Title of publication	The multiple core-shell structure in Cu24Ln6 cluster with magnetocaloric effect and slow magnetization relaxation.
Authors of publication	Xiong, Gang; Xu, Hang; Cui, Jian-Zhong; Wang, Qing-Lun; Zhao, Bin
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	15
Pages of publication	5639 - 5642
a	17.0801 ± 0.0007 Å
b	17.8312 ± 0.0007 Å
c	17.941 ± 0.0005 Å
α	87.087 ± 0.003°
β	71.317 ± 0.003°
γ	64.441 ± 0.004°
Cell volume	4645.2 ± 0.4 Å³
Cell temperature	123.3 ± 0.3 K
Ambient diffraction temperature	123.3 ± 0.3 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0722
Residual factor for significantly intense reflections	0.0597
Weighted residual factors for significantly intense reflections	0.1573
Weighted residual factors for all reflections included in the refinement	0.1641
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179999 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/93.	7029396.cif
108291	2014-03-30	cif/ Adding structures of 7029396, 7029397 via cif-deposit CGI script.	7029396.cif