Crystallography Open Database

Information card for entry 7236825

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Coordinates	7236825.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	TBH
Formula	C38 H20
Calculated formula	C38 H20
Title of publication	Contorted tetrabenzoacenes of varied conjugation: charge transport study with single-crystal field-effect transistors
Authors of publication	Huang, Ding-Chi; Kuo, Chi-Hsien; Ho, Man-Tzu; Lin, Bo-Chao; Peng, Wei-Tao; Chao, Ito; Hsu, Chao-Ping; Tao, Yu-Tai
Journal of publication	Journal of Materials Chemistry C
Year of publication	2017
Journal volume	5
Journal issue	31
Pages of publication	7935
a	18.8657 ± 0.0014 Å
b	7.6482 ± 0.0004 Å
c	31.436 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	4535.9 ± 0.5 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	2
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1293
Residual factor for significantly intense reflections	0.0554
Weighted residual factors for significantly intense reflections	0.1369
Weighted residual factors for all reflections included in the refinement	0.1865
Goodness-of-fit parameter for all reflections included in the refinement	0.975
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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