Crystallography Open Database

Information card for entry 7701247

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Coordinates	7701247.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H40 Al2
Calculated formula	C32 H40 Al2
Title of publication	A bis(aluminocenophane) with a short aluminum-aluminum single bond.
Authors of publication	Haider, Wasim; Andrada, Diego M.; Bischoff, Inga-Alexandra; Huch, Volker; Schäfer, André
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	40
Pages of publication	14953 - 14957
a	8.9879 ± 0.0003 Å
b	10.9776 ± 0.0003 Å
c	26.2559 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	2590.55 ± 0.13 Å³
Cell temperature	122 ± 2 K
Ambient diffraction temperature	122 ± 2 K
Number of distinct elements	3
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0283
Residual factor for significantly intense reflections	0.026
Weighted residual factors for significantly intense reflections	0.0678
Weighted residual factors for all reflections included in the refinement	0.0693
Goodness-of-fit parameter for all reflections included in the refinement	1.082
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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