Crystallography Open Database

Information card for entry 4088229

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Coordinates	4088229.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H102 Cl6 N2 O U2
Calculated formula	C52 H102 Cl6 N2 O U2
Title of publication	Synthetic Utility of Tetrabutylammonium Salts in Uranium Metallocene Chemistry
Authors of publication	Webster, Christopher L.; Langeslay, Ryan R.; Ziller, Joseph W.; Evans, William J.
Journal of publication	Organometallics
Year of publication	2016
Journal volume	35
Journal issue	4
Pages of publication	520
a	21.0303 ± 0.0012 Å
b	16.6868 ± 0.001 Å
c	17.6872 ± 0.001 Å
α	90°
β	103.962 ± 0.0007°
γ	90°
Cell volume	6023.6 ± 0.6 Å³
Cell temperature	143 ± 2 K
Ambient diffraction temperature	143 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0417
Residual factor for significantly intense reflections	0.0284
Weighted residual factors for significantly intense reflections	0.0644
Weighted residual factors for all reflections included in the refinement	0.0695
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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