Crystallography Open Database

Information card for entry 7211561

Preview

Coordinates	7211561.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H9 Cu3 I K N12
Calculated formula	C6 H9 Cu3 I K N12
Title of publication	In situ solvothermal syntheses of a heteronuclear copper(I)-alkaline metallic tetrazole-based coordination polymer
Authors of publication	Liu, Biao; Qiu, Yong-Cai; Peng, Guo; Deng, Hong
Journal of publication	CrystEngComm
Year of publication	2010
Journal volume	12
Journal issue	1
Pages of publication	270
a	9.3946 ± 0.0014 Å
b	13.26 ± 0.002 Å
c	12.7927 ± 0.0019 Å
α	90°
β	92.674 ± 0.002°
γ	90°
Cell volume	1591.9 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0408
Residual factor for significantly intense reflections	0.035
Weighted residual factors for significantly intense reflections	0.0923
Weighted residual factors for all reflections included in the refinement	0.0953
Goodness-of-fit parameter for all reflections included in the refinement	1.082
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
180446 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/15.	7211561.cif
92114	2014-01-12	cif/ Adding structures of 7211560, 7211561, 7211562 via cif-deposit CGI script.	7211561.cif