Crystallography Open Database

Information card for entry 7116230

Preview

Coordinates	7116230.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H10 Co K N10
Calculated formula	C15.96 H9.96 Co K N6
Title of publication	Dynamics of a caged imidazolium cation-toward understanding the order-disorder phase transition and the switchable dielectric constant.
Authors of publication	Zhang, Xi; Shao, Xiu-Dan; Li, Si-Chao; Cai, Ying; Yao, Ye-Feng; Xiong, Ren-Gen; Zhang, Wen
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2015
Journal volume	51
Journal issue	22
Pages of publication	4568 - 4571
a	8.7151 ± 0.0012 Å
b	8.7151 ± 0.0012 Å
c	19.011 ± 0.004 Å
α	90°
β	90°
γ	120°
Cell volume	1250.5 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	166
Hermann-Mauguin space group symbol	R -3 m :H
Hall space group symbol	-R 3 2"
Residual factor for all reflections	0.0418
Residual factor for significantly intense reflections	0.0302
Weighted residual factors for significantly intense reflections	0.095
Weighted residual factors for all reflections included in the refinement	0.0969
Goodness-of-fit parameter for all reflections included in the refinement	1.327
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
180276 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/62.	7116230.cif
133081	2015-03-06	cif/ Updating files of 7116230, 7116231 Original log message: Adding full bibliography for 7116230--7116231.cif.	7116230.cif
129311	2015-01-03	cif/ Adding structures of 7116230, 7116231 via cif-deposit CGI script.	7116230.cif