Crystallography Open Database

Information card for entry 7018926

Preview

Coordinates	7018926.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cu2 Ge2 H74 Mo18 Na8 O101
Calculated formula	Cu2 Ge2 Mo18 Na8 O101
SMILES	O=[Mo]1234[O]5[Mo]67([O]84[Ge]49[O]%10%11[Mo]%12%13%14([O]2[Mo]25([O]7[Mo]%11([O]%142)(O[Mo]2%10(O%12)(O[Mo]5(O[Mo](O3)(O[Mo]8(O1)(O6)(=O)=[O][Cu]13[O]9[Cu]6([O]=2)[O]=[Mo]278(O[Mo]9%10%11(=O)[O]%12[Mo]%14([O]2%11[Ge]2([O]%11%15[Mo]%16%17%18([O]9[Mo]9%12([O]%14[Mo]%15([O]%189)(O[Mo]%11(O%16)(O[Mo]9(O[Mo](O%10)(O8)(=O)(=O)[O]29)(=O)(=O)O%17)(=O)=[O]1)(=O)=O)(=O)=O)=O)[O]36)(=O)(O7)=O)=O)(=O)(=O)[O]45)(=O)(O%13)=O)=O)(=O)=O)(=O)=O)=O)(=O)=O.[Na+].O.O.O.O.[Na+].O.[Na+].O.[Na+].O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[Na+].O.[Na+].O.[Na+].O.O.O.O.[Na+].O.O.O.O.O.O.O
Title of publication	Four di-Cu(II)-substituted sandwich-type germanomolybdates obtained under different reaction conditions: from zero-dimensional to two-dimensional structure.
Authors of publication	Li, Suzhi; Guo, Yuan Yuan; Zhang, Dongdi; Ma, Pengtao; Qiu, Xiaoyang; Wang, Jingping; Niu, Jingyang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	17
Pages of publication	5235 - 5240
a	12.482 ± 0.007 Å
b	12.791 ± 0.008 Å
c	17.272 ± 0.015 Å
α	101.422 ± 0.014°
β	98.402 ± 0.013°
γ	115.982 ± 0.01°
Cell volume	2343 ± 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	0.0671
Residual factor for significantly intense reflections	0.0538
Weighted residual factors for significantly intense reflections	0.1284
Weighted residual factors for all reflections included in the refinement	0.1323
Goodness-of-fit parameter for all reflections included in the refinement	1.02
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7018926.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7018926.cif
55996	2012-05-08	cif/ Adding structures of 7018923, 7018924, 7018925, 7018926 via cif-deposit CGI script.	7018926.cif