Crystallography Open Database

Information card for entry 7205778

7205777 << 7205778 >> 7205779

Preview

Coordinates	7205778.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H14 Cu Mo3 N4 O9.5
Calculated formula	C14 H14 Cu Mo3 N4 O9.5
Title of publication	Polyoxometalate charge directed coordination assemblies: Macrocycles and polymer chains
Authors of publication	Hou, Guangfeng; Bi, Lihua; Li, Bao; Wang, Bin; Wu, Lixin
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	10
Pages of publication	3526
a	9.824 ± 0.005 Å
b	10.017 ± 0.006 Å
c	11.36 ± 0.007 Å
α	111.68 ± 0.02°
β	96.45 ± 0.02°
γ	94.56 ± 0.02°
Cell volume	1023.3 ± 1 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 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	0.0384
Residual factor for significantly intense reflections	0.0313
Weighted residual factors for significantly intense reflections	0.0777
Weighted residual factors for all reflections included in the refinement	0.0898
Goodness-of-fit parameter for all reflections included in the refinement	1.136
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.	7205778.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205778.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205778.cif
21007	2011-06-21	../uploads/cif-deposit/cod/cif Adding structures of 7205773, 7205774, 7205775, 7205776, 7205777, 7205778 via cif-deposit CGI script.	7205778.cif