Crystallography Open Database

Information card for entry 7046138

Preview

Coordinates	7046138.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H6.26 F1.74 O2
Calculated formula	C9 H6.264 F1.736 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	3.769 ± 0.009 Å
b	6.599 ± 0.015 Å
c	31.6 ± 0.07 Å
α	90°
β	91.27 ± 0.03°
γ	90°
Cell volume	786 ± 3 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	0.1139
Residual factor for significantly intense reflections	0.0957
Weighted residual factors for significantly intense reflections	0.2303
Weighted residual factors for all reflections included in the refinement	0.2547
Goodness-of-fit parameter for all reflections included in the refinement	0.958
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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