Crystallography Open Database

Information card for entry 1517873

Preview

Coordinates	1517873.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H13 Fe P5
Calculated formula	C9 H13 Fe P5
Title of publication	A comparative study of the coordination behavior of cyclo-P5and cyclo-As5ligand complexes towards the trinuclear Lewis acid complex (perfluoro-ortho-phenylene)mercury
Authors of publication	Fleischmann, Martin; Jones, James S.; Gabbaï, François P.; Scheer, Manfred
Journal of publication	Chem. Sci.
Year of publication	2015
Journal volume	6
Journal issue	1
Pages of publication	132
a	11.4347 ± 0.0001 Å
b	23.4865 ± 0.0002 Å
c	15.1315 ± 0.0001 Å
α	90°
β	90°
γ	90°
Cell volume	4063.73 ± 0.06 Å³
Cell temperature	123 ± 1 K
Ambient diffraction temperature	123 ± 1 K
Number of distinct elements	4
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0225
Residual factor for significantly intense reflections	0.0213
Weighted residual factors for significantly intense reflections	0.0541
Weighted residual factors for all reflections included in the refinement	0.0549
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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