Crystallography Open Database

Information card for entry 1536743

Preview

Coordinates	1536743.cif

Structure parameters

Chemical name	Na25 (Ce (H2 O)5 As4 W40 O140) (H2 O)63
Formula	As4 Ce H136 Na25 O208 W40
Calculated formula	As4 Ce Na25 O203 W40
SMILES	[W]1234(=O)O[W]567(=O)O[W]89(=O)(O4)O[W]4%10%11(=O)[O]%129[W](O8)(=O)(O4)(O[W]4(O5)(=O)O[W]5(=O)(=O)(O7)O[W](=O)(=O)([O]2[As]%12[O]65)(O3)O[W](O1)(O%10)(=O)O[W]123(O%11)=O)O[W]56(O4)(=O)=[O][Ce]4([OH2])([OH2])([OH2])([OH2])([O]=1)[O]=[W]17(=O)(O[W]89%10(=O)O[W]%11%12%13(=O)O[W]%14%15%16(=O)O[W]%17%18(=O)(O%11)O[W]%11%19(=O)(O5)O[W]5(O%17)(=O)(=O)O[W](O%12)(O8)(=O)(=O)[O]9%13[As]([O]5%18%19)[O]5%14[W](O%15)(O%10)(=O)(O1)O[W]5(O%16)(O%11)(=O)O6)O[W]156(=O)O[W]89%10(=O)O[W]%11%12%13(=O)O[W]%14%15(O8)(=O)O[W](O6)(=O)(O7)O[W]6(=O)(O%14)(=O)[O]%15[As]7[O]19[W]1(O%10)(=O)(O5)O[W](O%11)(=O)(O[W](=O)([O]7%12)(O%13)(O6)=O)O[W]5(=O)(=[O]4)(O1)O[W]146(=O)O[W]789(=O)O[W]%10%11%12(=O)O[W]%13%14(=O)(O7)O[W]7%15(=O)(O2)O[W]2(O%13)(=O)(=O)O[W](O8)(O6)(=O)(=O)[O]19[As]([O]2%14%15)[O]1%10[W](O%11)(O7)(=O)(O3)O[W]1(O%12)(O4)(=O)O5.[Na+].[Na+].O.O.O.O.[Na+].[Na+].O.O.O.O.[Na+].O.[Na+].O.O.O.O.O.O.[Na+].O.O.O.O.[Na+].O.O.O.O.[Na+].[Na+].[Na+].O.O.O.O.[Na+].O.O.O.O.[Na+].[Na+].O.O.O.O.[Na+].O.O.O.O.[Na+].O.O.O.O.[Na+].O.[Na+].O.[Na+].O.O.[Na+].O.[Na+].O.O.[Na+].[Na+].O.O.O.[Na+].O.O.O.O.[Na+].O.O
Title of publication	Cerium(III) complexes with lacunary polyoxotungstates. Synthesis and structural characterization of a novel heteropolyoxotungstate based on alpha - (Sb W9 O33)(9-) units
Authors of publication	Xue Ganglin; Vaissermann, J.; Gouzerh, P.
Journal of publication	Journal of Cluster Science
Year of publication	2002
Journal volume	13
Pages of publication	409 - 421
a	13.973 Å
b	22.656 Å
c	31.252 Å
α	90°
β	90°
γ	90°
Cell volume	9893.52 Å³
Number of distinct elements	6
Space group number	59
Hermann-Mauguin space group symbol	P n m m :2
Hall space group symbol	-P 2c 2bc
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176429 (current)	2016-02-13	cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary.	1536743.cif
176428	2016-02-13	cif/ (antanas@kurmis) Replacing _cod_cif_authors_sg_Hall tag with _cod_original_sg_symbol_Hall tag and _cod_cif_authors_sg_H-M tag with _cod_original_sg_symbol_H-M tag in multiple entries sine the replaced tags are deprecated according to the COD CIF dictionary.	1536743.cif
164580	2015-10-10	cif/ Adding structures of 1536743 via cif-deposit CGI script.	1536743.cif