Crystallography Open Database

Information card for entry 7132429

Preview

Coordinates	7132429.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H36 Al F11 N2
Calculated formula	C39 H36 Al F11 N2
Title of publication	The Lewis superacidic aluminium cation: [(NHC)Al(C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>]<sup/>.
Authors of publication	Ju, Shaoying; Zhang, Chi; Tang, Beili; Liu, Liu Leo; Stephan, Douglas W.; Wu, Yile
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2024
Journal volume	60
Journal issue	6
Pages of publication	698 - 701
a	14.4808 ± 0.0011 Å
b	12.6637 ± 0.0009 Å
c	20.244 ± 0.0014 Å
α	90°
β	90°
γ	90°
Cell volume	3712.4 ± 0.5 Å³
Cell temperature	260 K
Ambient diffraction temperature	260 K
Number of distinct elements	5
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.068
Residual factor for significantly intense reflections	0.0564
Weighted residual factors for significantly intense reflections	0.1304
Weighted residual factors for all reflections included in the refinement	0.1391
Goodness-of-fit parameter for all reflections included in the refinement	1.092
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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