Crystallography Open Database

Information card for entry 4116394

Preview

Coordinates	4116394.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Tris(pentafluorophenyl)alane
Formula	C27 H9 Al F15
Calculated formula	C27 H9 Al F15
Title of publication	Arene Complexes of Al(C6F5)3. Relationship to a Déjà Vu Silylium Ion
Authors of publication	Gregory S. Hair; Alan H. Cowley; Richard A. Jones; Brian G. McBurnett; Andreas Voigt
Journal of publication	Journal of the American Chemical Society
Year of publication	1999
Journal volume	121
Pages of publication	4922 - 4923
a	7.408 ± 0.001 Å
b	11.378 ± 0.001 Å
c	15.606 ± 0.001 Å
α	73.7 ± 0.01°
β	78.49 ± 0.01°
γ	84.74 ± 0.01°
Cell volume	1236.3 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.2372
Residual factor for significantly intense reflections	0.0844
Weighted residual factors for all reflections	0.2164
Weighted residual factors for significantly intense reflections	0.1495
Goodness-of-fit parameter for all reflections	1.017
Goodness-of-fit parameter for significantly intense reflections	1.222
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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