Crystallography Open Database

Information card for entry 1514424

Preview

Coordinates	1514424.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C136 Cl16 Gd2 N8 O74 Si2 W20
Calculated formula	C136 Cl16 Gd2 N8 O74 Si2 W20
Title of publication	Reversible switching of single-molecule magnet behaviors by transformation of dinuclear dysprosium cores in polyoxometalates
Authors of publication	Suzuki, Kosuke; Sato, Rinta; Mizuno, Noritaka
Journal of publication	Chemical Science
Year of publication	2013
Journal volume	4
Journal issue	2
Pages of publication	596
a	15.2981 ± 0.0001 Å
b	47.7123 ± 0.0004 Å
c	15.6288 ± 0.0001 Å
α	90°
β	108.609 ± 0.0005°
γ	90°
Cell volume	10811.2 ± 0.14 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	7
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	0.0702
Residual factor for significantly intense reflections	0.0659
Weighted residual factors for significantly intense reflections	0.1787
Weighted residual factors for all reflections included in the refinement	0.1867
Goodness-of-fit parameter for all reflections included in the refinement	1.179
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKY=a
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1514424.cif
110127	2014-04-18	cif/ Adding structures of 1514423, 1514424 via cif-deposit CGI script.	1514424.cif