Crystallography Open Database

Information card for entry 4120280

4120279 << 4120280 >> 4120281

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Coordinates	4120280.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C67 H140 K O22 Si4 U
Calculated formula	C67 H140 K O22 Si4 U
Title of publication	Tuning Uranium-Nitrogen Multiple Bond Formation with Ancillary Siloxide Ligands
Authors of publication	Clément Camp; Jacques Pécaut; Marinella Mazzanti
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	12101 - 12111
a	18.2032 ± 0.0012 Å
b	25.9028 ± 0.0011 Å
c	36.9447 ± 0.0018 Å
α	90°
β	90°
γ	90°
Cell volume	17419.9 ± 1.6 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.1853
Residual factor for significantly intense reflections	0.0729
Weighted residual factors for significantly intense reflections	0.1034
Weighted residual factors for all reflections included in the refinement	0.1384
Goodness-of-fit parameter for all reflections included in the refinement	0.98
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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