Crystallography Open Database

Information card for entry 7058330

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Coordinates	7058330.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H8 F4 O2
Calculated formula	C16 H8 F4 O2
Title of publication	Charge transfer complexes as colour changing and disappearing‒reappearing colour materials
Authors of publication	Sharada, Durgam; Saha, Arijit; Saha, Binoy K.
Journal of publication	New Journal of Chemistry
Year of publication	2019
Journal volume	43
Journal issue	20
Pages of publication	7562
a	6.6927 ± 0.0014 Å
b	7.6784 ± 0.0014 Å
c	7.7214 ± 0.0014 Å
α	106.506 ± 0.016°
β	105.114 ± 0.017°
γ	107.889 ± 0.018°
Cell volume	334.68 ± 0.14 Å³
Cell temperature	262 ± 0.02 K
Ambient diffraction temperature	262 ± 0.02 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	0.0884
Residual factor for significantly intense reflections	0.0549
Weighted residual factors for significantly intense reflections	0.1671
Weighted residual factors for all reflections included in the refinement	0.1903
Goodness-of-fit parameter for all reflections included in the refinement	1.087
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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