Crystallography Open Database

Information card for entry 4338282

Preview

Coordinates	4338282.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H143 N6 O62 S2 V W17
Calculated formula	C62 H143 N6 O62 S2 V0.9981 W17.0019
Title of publication	Synthesis and Characterization of Novel Wells-Dawson-Type Mono Vanadium(V)-Substituted Tungsto-polyoxometalate Isomers: 1- and 4-[S2VW17O62](5-).
Authors of publication	Ueda, Tadaharu; Ohnishi, Miho; Shiro, Motoo; Nambu, Jun-Ichi; Yonemura, Toshiaki; Boas, John F.; Bond, Alan M.
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	10
Pages of publication	4891 - 4898
a	18.3309 ± 0.0004 Å
b	20.3938 ± 0.0004 Å
c	30.927 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	11561.6 ± 1.2 Å³
Cell temperature	123 K
Ambient diffraction temperature	123 K
Number of distinct elements	7
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for significantly intense reflections	0.0236
Weighted residual factors for all reflections included in the refinement	0.04
Goodness-of-fit parameter for all reflections included in the refinement	1.221
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179485 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/82.	4338282.cif
115717	2014-06-05	cif/ Updating files of 4338282, 4338283 Original log message: Adding full bibliography for 4338282--4338283.cif.	4338282.cif
112337	2014-05-01	cif/ Adding structures of 4338282 via cif-deposit CGI script.	4338282.cif