Crystallography Open Database

Information card for entry 4071488

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Coordinates	4071488.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H20 Fe Li N
Calculated formula	C16 H20 Fe Li N
Title of publication	Structural Features of Lithio[3]ferrocenophane Systems Bearing Stabilizing Dimethylamino Substituents
Authors of publication	Chen, Chao; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	13
Pages of publication	3248
a	7.5675 ± 0.0001 Å
b	9.2846 ± 0.0002 Å
c	10.4913 ± 0.0002 Å
α	106.946 ± 0.001°
β	98.02 ± 0.001°
γ	102.853 ± 0.001°
Cell volume	670.75 ± 0.02 Å³
Cell temperature	198 ± 2 K
Ambient diffraction temperature	198 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0279
Residual factor for significantly intense reflections	0.026
Weighted residual factors for significantly intense reflections	0.0683
Weighted residual factors for all reflections included in the refinement	0.0696
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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