Crystallography Open Database

Information card for entry 4507955

Preview

Coordinates	4507955.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	H115 Mo29 N3 Na2 O158 Pr6
Calculated formula	Mo29 N3 Na2 O158 Pr6
Title of publication	A Series of Multi-Dimensional Lanthanide-Containing Peroxoisopolymolybdates
Authors of publication	Wei, Jingjing; Yang, Lu; Ma, Pengtao; Wang, Jingping; Niu, Jingyang
Journal of publication	Crystal Growth & Design
Year of publication	2013
Journal volume	13
Journal issue	8
Pages of publication	3554
a	37.099 ± 0.007 Å
b	16.71 ± 0.003 Å
c	28.416 ± 0.009 Å
α	90°
β	123.894 ± 0.002°
γ	90°
Cell volume	14622 ± 6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0508
Residual factor for significantly intense reflections	0.0372
Weighted residual factors for significantly intense reflections	0.0975
Weighted residual factors for all reflections included in the refinement	0.103
Goodness-of-fit parameter for all reflections included in the refinement	1.067
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
179615 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/79.	4507955.cif
87772	2013-08-27	cif/ Adding structures of 4507954, 4507955, 4507956, 4507957, 4507958, 4507959 via cif-deposit CGI script.	4507955.cif