Crystallography Open Database

Information card for entry 7005834

Preview

Coordinates	7005834.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Bi2 Co4 H96 Na14 O116 W18
Calculated formula	Bi2 Co4 Na14 O114 W18
SMILES	[O]1=[W]234(O[W]567(O[W]891([O]1[Bi]%10%11%12[O]7[Co]7%13%14%15[O]=[W]%16%17%18([O]%19%20[W](O[W]%21%19(O%17)(O[W]%17%19%22([O]%23%24[W](O[W]%23(O%17)(=O)(O9)=[O][Co]9%17%231[O]7([Co]%20%24[O]258)[Bi]1(O%18)([O]%13[W]257(O[W]8%13%18(O[W]%20(O2)([O]58[Co]2([O]58[W]%24%25(O[W]5(=[O]%14)(O[W]8(O[W]58([O]%142[W](O[W]%14(O5)(=O)(O%18)O%20)(=[O]9)(O8)(O%12)=O)(O%24)=O)(O%10)(=O)O%25)(=O)O7)(O%13)=O)[O]%11%15%17)([O]%231)=O)=O)=O)O%19)(O%21)(O3)(O%22)=O)=O)=O)(=O)(O%16)(O4)O6)=O)=O)=O)=O.[Na+].O.O.[Na+].O.O.[Na+].O.O.[Na+].O.O.O.O.[Na+].O.[Na+].O.O.O.[Na+].O.O.O.O.O.[Na+].O.O.O.O.[Na+].O.O.[Na+].O.O.[Na+].O.O.[Na+].O.O.O.O.O.[Na+].O.O.O.[Na+].O.O.O.O.O.O.O.O.O
Title of publication	The novel sandwich-type heteropolyoxotungstates [M2Bi2(beta-B-MW9O34)2]14- (M = Co(II), Zn(II)): beta-type dimeric heteropolyanions with a transition metal as the central heteroatom and Bi(III) and M as linking atoms.
Authors of publication	Liu, Ying; Liu, Bin; Xue, Ganglin; Hu, Huaiming; Fu, Feng; Wang, Jiwu
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2007
Journal issue	33
Pages of publication	3634 - 3639
a	13.509 ± 0.003 Å
b	14.427 ± 0.003 Å
c	15.3 ± 0.003 Å
α	65.28 ± 0.03°
β	89.35 ± 0.03°
γ	72.08 ± 0.03°
Cell volume	2553.4 ± 1.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1131
Residual factor for significantly intense reflections	0.0656
Weighted residual factors for significantly intense reflections	0.1659
Weighted residual factors for all reflections included in the refinement	0.1992
Goodness-of-fit parameter for all reflections included in the refinement	1.031
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
179762 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/58.	7005834.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7005834.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7005834.cif
1186	2010-06-03	Adding CIFs from Chem-Comm-2010_20-22/ and Dalton-Trans-2007/ processing.	7005834.cif