Crystallography Open Database

Information card for entry 1517010

Preview

Coordinates	1517010.cif

Structure parameters

Formula	C14 H55 Er2 N6 O69 W12
Calculated formula	C14 H55 Er2 N6 O69 W12
Title of publication	Coordination polymers of lanthanide elements and metatungstate: Syntheses, structure and magnetic property
Authors of publication	Dan-Dan Liu; Ya-Guang Chen
Journal of publication	Inorganica Chimica Acta
Year of publication	2013
Journal volume	401
Pages of publication	70 - 75
a	12.9075 ± 0.0012 Å
b	25.135 ± 0.002 Å
c	21.631 ± 0.002 Å
α	90°
β	98.584 ± 0.001°
γ	90°
Cell volume	6939.1 ± 1.1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.0846
Residual factor for significantly intense reflections	0.0474
Weighted residual factors for significantly intense reflections	0.1013
Weighted residual factors for all reflections included in the refinement	0.1145
Goodness-of-fit parameter for all reflections included in the refinement	0.95
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
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.	1517010.cif
119878	2014-07-09	cif/ Adding structures of 1517010 via cif-deposit CGI script.	1517010.cif