Crystallography Open Database

Information card for entry 7001789

Preview

Coordinates	7001789.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C5 H41 Mo24 N5 O88.5 Sb4 Si2
Calculated formula	C5 H21 Mo24 N5 O88.5 Sb4 Si2
Title of publication	Synthesis and characterization of a novel POM compound containing two different layers stacked alternately
Authors of publication	Shi, Shu-Yun; Wang, Yan; Cui, Xiao-Bing; Wang, Guo-Wu; Yang, Guang-Di; Xu, Ji-Qing
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	31
Pages of publication	6099
a	20.544 ± 0.004 Å
b	20.438 ± 0.004 Å
c	20.551 ± 0.004 Å
α	90°
β	104.37 ± 0.03°
γ	90°
Cell volume	8359 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0672
Residual factor for significantly intense reflections	0.0539
Weighted residual factors for significantly intense reflections	0.1675
Weighted residual factors for all reflections included in the refinement	0.1775
Goodness-of-fit parameter for all reflections included in the refinement	1.092
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.	7001789.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7001789.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7001789.cif
1143	2010-05-03	cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.	7001789.cif