Crystallography Open Database

Information card for entry 4330674

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Structure parameters

Formula	C18 H9 As F12 O3
Calculated formula	C18 H9 As F12 O3
SMILES	c12ccccc1C(C(F)(F)F)(C(F)(F)F)O[As]12(c2ccccc2C(C(F)(F)F)(C(F)(F)F)O1)O
Title of publication	Synthesis and Characterization of Antiapicophilic Arsoranes and Related Compounds
Authors of publication	Xin-Dong Jiang; Shiro Matsukawa; Satoshi Kojima; Yohsuke Yamamoto
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	10996 - 11006
a	11.534 ± 0.0002 Å
b	12.658 ± 0.0002 Å
c	15.005 ± 0.0002 Å
α	67.291 ± 0.001°
β	87.699 ± 0.001°
γ	88.652 ± 0.001°
Cell volume	2019.16 ± 0.06 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0532
Residual factor for significantly intense reflections	0.0455
Weighted residual factors for significantly intense reflections	0.1176
Weighted residual factors for all reflections included in the refinement	0.1309
Goodness-of-fit parameter for all reflections included in the refinement	1.086
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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