Crystallography Open Database

Information card for entry 7200629

7200628 << 7200629 >> 7200630

Preview

Coordinates	7200629.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H6 Cu6 I3 N9
Calculated formula	C6 H6 Cu6 I3 N9
Title of publication	Hydrothermal syntheses and structures of three novel coordination polymers assembled from 1,2,3-triazolate ligands
Authors of publication	Zhou, Xin-Hui; Peng, Yan-Hong; Du, Xiao-Di; Zuo, Jing-Lin; You, Xiao-Zeng
Journal of publication	CrystEngComm
Year of publication	2009
Journal volume	11
Journal issue	9
Pages of publication	1964
a	17.54 ± 0.004 Å
b	18.008 ± 0.004 Å
c	11.256 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	3555.3 ± 1.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0851
Residual factor for significantly intense reflections	0.0589
Weighted residual factors for significantly intense reflections	0.1096
Weighted residual factors for all reflections included in the refinement	0.1185
Goodness-of-fit parameter for all reflections included in the refinement	1.056
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
180337 (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 7/20/06.	7200629.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7200629.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7200629.cif
1167	2010-05-13	cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19.	7200629.cif