Crystallography Open Database

Information card for entry 1508158

Preview

Coordinates	1508158.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H146 N10 O92 P2 W22 Y2
Calculated formula	C44 H126 N10 O92 P2 W22 Y2
Title of publication	Syntheses, structures and properties of dimeric rare earth derivatives based on monovacant Keggin-type polyoxotungstates
Authors of publication	Zhang, Dongdi; Zhang, Chao; Chen, Huanni; Ma, Pengtao; Wang, Jingping; Niu, Jingyang
Journal of publication	Inorganica Chimica Acta
Year of publication	2012
Journal volume	391
Pages of publication	218 - 223
a	25.03 ± 0.002 Å
b	12.7022 ± 0.001 Å
c	22.3103 ± 0.0018 Å
α	90°
β	115.156 ± 0.001°
γ	90°
Cell volume	6420.5 ± 0.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0713
Residual factor for significantly intense reflections	0.0414
Weighted residual factors for significantly intense reflections	0.0978
Weighted residual factors for all reflections included in the refinement	0.1091
Goodness-of-fit parameter for all reflections included in the refinement	1.017
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.	1508158.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1508158.cif
62704	2012-07-09	cif/ Adding structures of 1508158 via cif-deposit CGI script.	1508158.cif