Crystallography Open Database

Information card for entry 4067796

Preview

Coordinates	4067796.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H57 Co
Calculated formula	C49 H57 Co
Title of publication	An Improved Protocol for the Synthesis of [(η4-C4R4)Co(η5-C5H5)] Complexes
Authors of publication	Bertrand, Guillaume; Tortech, Ludovic; Fichou, Denis; Malacria, Max; Aubert, Corinne; Gandon, Vincent
Journal of publication	Organometallics
Year of publication	2012
Journal volume	31
Journal issue	1
Pages of publication	126
a	10.7152 ± 0.0003 Å
b	11.6509 ± 0.0004 Å
c	17.0103 ± 0.0005 Å
α	79.647 ± 0.001°
β	71.889 ± 0.002°
γ	89.139 ± 0.001°
Cell volume	1983.63 ± 0.11 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0725
Residual factor for significantly intense reflections	0.0558
Weighted residual factors for significantly intense reflections	0.1453
Weighted residual factors for all reflections included in the refinement	0.1584
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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