Crystallography Open Database

Information card for entry 7046144

Preview

Coordinates	7046144.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H5 F1.8 O2
Calculated formula	C9 H5 F1.802 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	3.7363 ± 0.0016 Å
b	6.525 ± 0.003 Å
c	32.294 ± 0.012 Å
α	90°
β	91.54 ± 0.03°
γ	90°
Cell volume	787 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.1302
Residual factor for significantly intense reflections	0.0969
Weighted residual factors for significantly intense reflections	0.2133
Weighted residual factors for all reflections included in the refinement	0.2389
Goodness-of-fit parameter for all reflections included in the refinement	1.085
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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