Crystallography Open Database

Information card for entry 7118339

Preview

Coordinates	7118339.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H16 N2
Calculated formula	C24 H16 N2
SMILES	c1ccc(cc1)C(=C\c1ccc(cc1)/C=C(C#N)/c1ccccc1)\C#N
Title of publication	An ambipolar organic field-effect transistor based on an AIE-active single crystal with a high mobility level of 2.0 cm2V−1s−1
Authors of publication	Deng, Jian; Xu, Yuanxiang; Liu, Liqun; Feng, Cunfang; Tang, Jia; Gao, Yu; Wang, Yan; Yang, Bing; Lu, Ping; Yang, Wensheng; Ma, Yuguang
Journal of publication	Chem. Commun.
Year of publication	2016
a	19.5 ± 0.012 Å
b	6.929 ± 0.004 Å
c	26.031 ± 0.016 Å
α	90°
β	90°
γ	90°
Cell volume	3517 ± 4 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	3
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.1099
Residual factor for significantly intense reflections	0.0948
Weighted residual factors for significantly intense reflections	0.2384
Weighted residual factors for all reflections included in the refinement	0.2529
Goodness-of-fit parameter for all reflections included in the refinement	1.048
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
182221 (current)	2016-04-20	cif/7 Fixing Z values and formulae	7118339.cif
173530	2016-01-06	cif/ Adding structures of 7118339 via cif-deposit CGI script.	7118339.cif