Crystallography Open Database

Information card for entry 4518050

Preview

Coordinates	4518050.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	NBTA
Formula	C24 H14 N2 S2
Calculated formula	C24 H14 N2 S2
Title of publication	Efficient Organic Light-Emitting Transistors Based on High-Quality Ambipolar Single Crystals.
Authors of publication	Wan, Yuejuan; Deng, Jian; Wu, Wanling; Zhou, Jiadong; Niu, Quan; Li, Haoyuan; Yu, Huakang; Gu, Cheng; Ma, Yuguang
Journal of publication	ACS applied materials & interfaces
Year of publication	2020
Journal volume	12
Journal issue	39
Pages of publication	43976 - 43983
a	6.95686 ± 0.00016 Å
b	4.79577 ± 0.00013 Å
c	28.14 ± 0.0007 Å
α	90°
β	94.683 ± 0.002°
γ	90°
Cell volume	935.71 ± 0.04 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	150 ± 0.1 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0411
Residual factor for significantly intense reflections	0.0403
Weighted residual factors for significantly intense reflections	0.1158
Weighted residual factors for all reflections included in the refinement	0.1165
Goodness-of-fit parameter for all reflections included in the refinement	1.078
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
256983 (current)	2020-10-04	cif/ Updating files of 4518050 Original log message: Adding full bibliography for 4518050.cif.	4518050.cif
256530	2020-09-19	cif/ Adding structures of 4518050 via cif-deposit CGI script.	4518050.cif