Crystallography Open Database

Information card for entry 7234273

Preview

Coordinates	7234273.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	C6-ATTDK
Chemical name	2,5,9,12-Tetrahexyl-7,14-dihydro-7,14-ethanoanthra [1,2-b:4,3-b?:5,6-b??:8,7-b???]tetrathiophene-15,16-dione
Formula	C51 H65 O2 S4
Calculated formula	C51 H65 O2 S4
Title of publication	Evaluation of semiconducting molecular thin films solution-processed via the photoprecursor approach: the case of hexyl-substituted thienoanthracenes
Authors of publication	Cassandre Quinton; Mitsuharu Suzuki; Yoshitaka Kaneshige; Yuki Tatenaka; Chiho Katagiri; Yuji Yamaguchi; Daiki Kuzuhara; Naoki Aratani; Ken-ichi Nakayama; Hiroko Yamada
Journal of publication	Journal of Materials Chemistry C
Year of publication	2015
Journal volume	3
Pages of publication	5995 - 6005
a	10.9591 ± 0.0003 Å
b	11.813 ± 0.0003 Å
c	19.6453 ± 0.0005 Å
α	104.659 ± 0.001°
β	96.32 ± 0.001°
γ	103.82 ± 0.001°
Cell volume	2349.57 ± 0.11 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0939
Residual factor for significantly intense reflections	0.0605
Weighted residual factors for significantly intense reflections	0.1633
Weighted residual factors for all reflections included in the refinement	0.193
Goodness-of-fit parameter for all reflections included in the refinement	1.102
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
218962 (current)	2019-10-01	cif/ Adding structures of 7234272, 7234273, 7234274 via cif-deposit CGI script.	7234273.cif