Crystallography Open Database

Information card for entry 4502574

Preview

Coordinates	4502574.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	As4 H144 K7 Na6 Nd3 O212 W41
Calculated formula	As4 K3 Na3 Nd3 O193 W41
Title of publication	Disassembly and Reassembly of Polyoxometalates: The Formation of Chains from an Adaptable Precursor
Authors of publication	Ritchie, Chris; Boskovic, Colette
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	2
Pages of publication	488
a	20.454 ± 0.003 Å
b	21.893 ± 0.004 Å
c	23.565 ± 0.004 Å
α	87.502 ± 0.003°
β	81.844 ± 0.003°
γ	70.296 ± 0.003°
Cell volume	9834 ± 3 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1302
Residual factor for significantly intense reflections	0.0974
Weighted residual factors for significantly intense reflections	0.2141
Weighted residual factors for all reflections included in the refinement	0.2347
Goodness-of-fit parameter for all reflections included in the refinement	1.11
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
179556 (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 4/50/25.	4502574.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502574.cif
36479	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4502574, 4502575 via cif-deposit CGI script.	4502574.cif