Crystallography Open Database

Information card for entry 7020833

7020832 << 7020833 >> 7020834

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Coordinates	7020833.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	H42 Ni6 O56 Si W9
Calculated formula	Ni6 O56 Si W9
Title of publication	Combination between [B-α-SiW9O34] unit and triangular inorganic Ni6 core under hydrothermal conditions: from monomer to rare dimer with malposed dodeca-nickel centers.
Authors of publication	Yang, Lei; Huo, Yu; Niu, Jingyang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	2
Pages of publication	364 - 367
a	18.8278 ± 0.0015 Å
b	20.7853 ± 0.0016 Å
c	12.2101 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	4778.3 ± 0.7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.057
Residual factor for significantly intense reflections	0.0352
Weighted residual factors for significantly intense reflections	0.0754
Weighted residual factors for all reflections included in the refinement	0.0818
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
179913 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/08.	7020833.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7020833.cif
73680	2013-02-21	cif/ Adding structures of 7020832, 7020833 via cif-deposit CGI script.	7020833.cif