Crystallography Open Database

Information card for entry 7243787

Preview

Coordinates	7243787.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	2,6-diphenyldithieno[3,2-b:2',3'-d]furan
Formula	C20 H12 O S2
Calculated formula	C20 H12 O S2
Title of publication	Synthesis of dithienofurans via cascade copper catalysed dual C–S coupling and ring closure reactions under mild conditions
Authors of publication	Zhou, Lu; Chen, Zhaopeng; Li, Jiahui; Li, Baolin
Journal of publication	RSC Advances
Year of publication	2021
Journal volume	11
Journal issue	54
Pages of publication	34071 - 34078
a	16.763 ± 0.002 Å
b	5.691 ± 0.001 Å
c	7.7824 ± 0.0011 Å
α	90°
β	97.279 ± 0.014°
γ	90°
Cell volume	736.44 ± 0.19 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	0.094
Residual factor for significantly intense reflections	0.061
Weighted residual factors for significantly intense reflections	0.1248
Weighted residual factors for all reflections included in the refinement	0.1449
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
270146 (current)	2021-10-29	cif/ Adding structures of 7243786, 7243787 via cif-deposit CGI script.	7243787.cif