Crystallography Open Database

Information card for entry 7028457

Preview

Coordinates	7028457.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cr H24 Mo6 N3 O27
Calculated formula	Cr H24 Mo6 N6 O30
SMILES	[NH4+].[NH4+].O.[NH4+].[OH]12[Mo]34(O[Mo]56([O]7[Cr]891([OH]1[Mo]%10([O]9[Mo]9([O]8[Mo]2(O9)(O4)(=O)=O)(O%10)(=O)=O)(O[Mo]71(O6)(=O)=O)(=O)=O)[O]35)(=O)=O)(=O)=O.O.O.N.[NH4+].O.[NH4+].O.O
Title of publication	A direct anchoring of Anderson-type polyoxometalates in aqueous media with tripodal ligands especially containing the carboxyl group.
Authors of publication	Zhang, Jiangwei; Huang, Yichao; Zhang, Jin; She, Shan; Hao, Jian; Wei, Yongge
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	7
Pages of publication	2722 - 2725
a	11.3563 ± 0.0006 Å
b	10.9306 ± 0.0005 Å
c	11.7567 ± 0.0005 Å
α	90°
β	100.137 ± 0.004°
γ	90°
Cell volume	1436.59 ± 0.12 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0597
Residual factor for significantly intense reflections	0.0513
Weighted residual factors for significantly intense reflections	0.1017
Weighted residual factors for all reflections included in the refinement	0.1096
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.	7028457.cif
105322	2014-03-12	cif/ Adding structures of 7028455, 7028456, 7028457 via cif-deposit CGI script.	7028457.cif