Crystallography Open Database

Information card for entry 7060542

Preview

Coordinates	7060542.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H6 F10 N2 O2
Calculated formula	C22 H6 F10 N2 O2
Title of publication	Preponderant role of pentafluorophenyl moieties for tuning the electronic properties of extended benzodifuran-azomethine derivatives
Authors of publication	Moussallem, Chady; Allain, Magali; Gohier, Frédéric; Frère, Pierre
Journal of publication	New Journal of Chemistry
Year of publication	2021
Journal volume	45
Journal issue	19
Pages of publication	8647 - 8653
a	11.3307 ± 0.0007 Å
b	7.8416 ± 0.0007 Å
c	11.397 ± 0.001 Å
α	90°
β	116.681 ± 0.005°
γ	90°
Cell volume	904.81 ± 0.13 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for significantly intense reflections	0.0391
Weighted residual factors for all reflections included in the refinement	0.1156
Goodness-of-fit parameter for all reflections included in the refinement	1.066
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7060542.html