Crystallography Open Database

Information card for entry 4135322

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Coordinates	4135322.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C78 H160 N2 O16 Si4 U
Calculated formula	C78 H160 N2 O16 Si4 U
Title of publication	Photochemical Synthesis of a Stable Terminal Uranium(VI) Nitride
Authors of publication	Barluzzi, Luciano; Scopelliti, Rosario; Mazzanti, Marinella
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
a	14.10407 ± 0.00017 Å
b	16.7659 ± 0.0002 Å
c	19.9097 ± 0.0002 Å
α	88.6774 ± 0.0009°
β	81.8561 ± 0.001°
γ	86.4823 ± 0.001°
Cell volume	4651.24 ± 0.09 Å³
Cell temperature	140 ± 0.1 K
Ambient diffraction temperature	140 ± 0.1 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0203
Residual factor for significantly intense reflections	0.0188
Weighted residual factors for significantly intense reflections	0.044
Weighted residual factors for all reflections included in the refinement	0.0446
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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