Crystallography Open Database

Information card for entry 7205414

7205413 << 7205414 >> 7205415

Preview

Coordinates	7205414.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H88 Cu Ge2 K6 Mo4 N12 O92 W20
Calculated formula	C36 H84 Cu Ge2 K6 Mo3.868 N12 O92 W20.132
Title of publication	Multidimensional frameworks constructed from Keggin-type heteropoly blue of molybdenum‒tungsten cluster
Authors of publication	Wang, Yuchao; Xu, Lin; Jiang, Ning; Zhao, Lili; Li, Fengyan; Liu, Xizheng
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	2
Pages of publication	410
a	12.5854 ± 0.001 Å
b	12.7542 ± 0.001 Å
c	21.544 ± 0.0017 Å
α	78.741 ± 0.001°
β	75.222 ± 0.001°
γ	61.183 ± 0.001°
Cell volume	2919 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	9
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0693
Residual factor for significantly intense reflections	0.0445
Weighted residual factors for significantly intense reflections	0.0983
Weighted residual factors for all reflections included in the refinement	0.1104
Goodness-of-fit parameter for all reflections included in the refinement	1
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
180385 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/54.	7205414.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205414.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205414.cif
14670	2011-03-11	../uploads/cif-deposit/cod/cif Adding structures of 7205413, 7205414 via cif-deposit CGI script.	7205414.cif