Crystallography Open Database

Information card for entry 4119558

4119557 << 4119558 >> 4119559

Preview

Coordinates	4119558.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H12 Co D4 K N8
Calculated formula	C10 H12 Co D4 K N8
Title of publication	Tunable and Switchable Dielectric Constant in an Amphidynamic Crystal
Authors of publication	Wen Zhang; Heng-Yun Ye; Robert Graf; Hans W. Spiess; Ye-Feng Yao; Run-Qiang Zhu; Ren-Gen Xiong
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	5230 - 5233
a	8.2371 ± 0.0013 Å
b	8.2371 ± 0.0013 Å
c	11.6 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	787.1 ± 0.3 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 K
Number of distinct elements	6
Space group number	128
Hermann-Mauguin space group symbol	P 4/m n c
Hall space group symbol	-P 4 2n
Residual factor for all reflections	0.0926
Residual factor for significantly intense reflections	0.0926
Weighted residual factors for significantly intense reflections	0.198
Weighted residual factors for all reflections included in the refinement	0.198
Goodness-of-fit parameter for all reflections included in the refinement	1.31
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
178966 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/95.	4119558.cif
103717	2014-03-06	cif/ Adding structures of 4119558 via cif-deposit CGI script.	4119558.cif