Crystallography Open Database

Information card for entry 4060175

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Coordinates	Coordinates are not available: file is not found.

Structure parameters

Formula	C20 H22 Fe O2
Calculated formula	C20 H22 Fe O2
Journal of publication	Organometallics
Year of publication	2005
a	14.2647 ± 0.0004 Å
b	10.9838 ± 0.0003 Å
c	10.693 ± 0.0002 Å
α	90°
β	90.252 ± 0.001°
γ	90°
Cell volume	1675.37 ± 0.07 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 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	0.0524
Residual factor for significantly intense reflections	0.0371
Weighted residual factors for significantly intense reflections	0.0812
Weighted residual factors for all reflections included in the refinement	0.0882
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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