Crystallography Open Database

Information card for entry 1564647

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Coordinates	1564647.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H17 Al F37 Fe I O4 P5
Calculated formula	C29 H17 Al F37 Fe I O4 P5
Title of publication	Substituted aromatic pentaphosphole ligands ‒ a journey across the p-block
Authors of publication	Riesinger, Christoph; Balázs, Gábor; Seidl, Michael; Scheer, Manfred
Journal of publication	Chemical Science
Year of publication	2021
a	31.0024 ± 0.0008 Å
b	19.5946 ± 0.0003 Å
c	19.9635 ± 0.0006 Å
α	90°
β	127.644 ± 0.004°
γ	90°
Cell volume	9602.7 ± 0.7 Å³
Cell temperature	122.99 ± 0.1 K
Ambient diffraction temperature	122.99 ± 0.1 K
Number of distinct elements	8
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0478
Residual factor for significantly intense reflections	0.0431
Weighted residual factors for significantly intense reflections	0.1133
Weighted residual factors for all reflections included in the refinement	0.1174
Goodness-of-fit parameter for all reflections included in the refinement	1.021
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.39222 Å
Diffraction radiation type	CuKβ
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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