Crystallography Open Database

Information card for entry 4121303

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Coordinates	4121303.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H36 Co2 F4 P2
Calculated formula	C38 H36 Co2 F4 P2
Title of publication	Cobalt Fluorocarbenes: Cycloaddition Reactions with Tetrafluoroethylene and Reactivity of the Perfluorometallacyclic Products
Authors of publication	Daniel J. Harrison; Graham M. Lee; Matthew C. Leclerc; Ilia Korobkov; R. Tom Baker
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	18296 - 18299
a	8.5304 ± 0.0003 Å
b	9.1085 ± 0.0003 Å
c	11.5135 ± 0.0004 Å
α	106.495 ± 0.001°
β	93.149 ± 0.001°
γ	102.968 ± 0.001°
Cell volume	829.13 ± 0.05 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 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	0.0283
Residual factor for significantly intense reflections	0.0244
Weighted residual factors for significantly intense reflections	0.0658
Weighted residual factors for all reflections included in the refinement	0.0683
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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