Crystallography Open Database

Information card for entry 7108337

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Coordinates	7108337.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H68 Al2 P2
Calculated formula	C44 H68 Al2 P2
Title of publication	Alkynide and acetonitrile activation by strained AlPC2 heterocycles
Authors of publication	Steffi Roters; Alexander Hepp; J. Chris Slootweg; Koop Lammertsma; Werner Uhl
Journal of publication	Chem.Commun.
Year of publication	2012
Journal volume	48
Pages of publication	9616
a	17.8586 ± 0.0007 Å
b	10.4392 ± 0.0004 Å
c	24.8146 ± 0.001 Å
α	90°
β	104.841 ± 0.001°
γ	90°
Cell volume	4471.8 ± 0.3 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0965
Residual factor for significantly intense reflections	0.0629
Weighted residual factors for significantly intense reflections	0.1642
Weighted residual factors for all reflections included in the refinement	0.186
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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