Crystallography Open Database

Information card for entry 7046127

Preview

Coordinates	7046127.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H6 F2 O2
Calculated formula	C9 H6 F2 O2
Title of publication	Syntheses, structures and efficient visible light-driven photocatalytic properties of layered cuprous halides based on two types of building units.
Authors of publication	Sun, Ai-Huan; Wei, Qi; Fu, Ai-Ping; Han, Song-De; Li, Jin-Hua; Wang, Guo-Ming
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	20
Pages of publication	6965 - 6972
a	3.8154 ± 0.0004 Å
b	6.3634 ± 0.0006 Å
c	32.845 ± 0.003 Å
α	90°
β	91.146 ± 0.003°
γ	90°
Cell volume	797.28 ± 0.13 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0754
Residual factor for significantly intense reflections	0.0605
Weighted residual factors for significantly intense reflections	0.1473
Weighted residual factors for all reflections included in the refinement	0.1592
Goodness-of-fit parameter for all reflections included in the refinement	1.075
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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