Crystallography Open Database

Information card for entry 1512840

Preview

Coordinates	1512840.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H52 Mo12 N8 O50 P Tb
Calculated formula	C48 H48 Mo12 N8 O48 P Tb
Title of publication	New polyoxometalate-based mononuclear lanthanide complexes with slow relaxation of magnetization
Authors of publication	Wenzhe Zhou; Xiaojia Feng; Hongshan Ke; Yangguang Li; Jinkui Tang; Enbo Wang
Journal of publication	Inorganica Chimica Acta
Year of publication	2013
Journal volume	394
Pages of publication	770 - 775
a	16.858 ± 0.003 Å
b	16.858 ± 0.003 Å
c	28.341 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	8054 ± 3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	126
Hermann-Mauguin space group symbol	P 4/n n c :2
Hall space group symbol	-P 4a 2bc
Residual factor for all reflections	0.0657
Residual factor for significantly intense reflections	0.0565
Weighted residual factors for significantly intense reflections	0.1399
Weighted residual factors for all reflections included in the refinement	0.1449
Goodness-of-fit parameter for all reflections included in the refinement	1.074
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.	1512840.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1512840.cif
90987	2013-11-22	cif/ Adding structures of 1512840 via cif-deposit CGI script.	1512840.cif