Crystallography Open Database

Information card for entry 4001417

Preview

Coordinates	4001417.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H10 F6 N4 S4
Calculated formula	C24 H10 F6 N4 S4
SMILES	FC(c1ccc(cc1)c1cnc(s1)c1nc2c(s1)nc(s2)c1ncc(s1)c1ccc(cc1)C(F)(F)F)(F)F
Title of publication	n-Type Organic Field-Effect Transistors with High Electron Mobilities Based on Thiazole−Thiazolothiazole Conjugated Molecules
Authors of publication	Mamada, Masashi; Nishida, Jun-ichi; Kumaki, Daisuke; Tokito, Shizuo; Yamashita, Yoshiro
Journal of publication	Chemistry of Materials
Year of publication	2007
Journal volume	19
Journal issue	22
Pages of publication	5404
a	8.43 ± 0.01 Å
b	13.05 ± 0.02 Å
c	16.35 ± 0.03 Å
α	93.22 ± 0.06°
β	101.18 ± 0.05°
γ	103.56 ± 0.05°
Cell volume	1706 ± 5 Å³
Cell temperature	93.2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0422
Weighted residual factors for all reflections included in the refinement	0.084
Goodness-of-fit parameter for all reflections included in the refinement	0.989
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4001417.cif
120073	2014-07-11	Adding DOIs to range 4/00 structures.	4001417.cif
45247	2012-03-20	../uploads/cif-deposit/cod/cif Adding structures of 4001416, 4001417 via cif-deposit CGI script.	4001417.cif