Crystallography Open Database

Information card for entry 1562341

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Coordinates	1562341.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H162 K N2 O24 Si6 U2
Calculated formula	C72 H162 K N2 O24 Si6 U2
Title of publication	Synthesis, Structure, and Reactivity of Uranium(VI) Nitrides
Authors of publication	Barluzzi, Luciano; Hsueh, Fang-Che; Scopelliti, Rosario; Atkinson, Benjamin E.; Kaltsoyannis, Nikolas; Mazzanti, Marinella
Journal of publication	Chemical Science
Year of publication	2021
a	13.4396 ± 0.0003 Å
b	17.7067 ± 0.0003 Å
c	25.0094 ± 0.0005 Å
α	80.0596 ± 0.0015°
β	88.3887 ± 0.0015°
γ	71.629 ± 0.0016°
Cell volume	5561.2 ± 0.2 Å³
Cell temperature	140 ± 0.1 K
Ambient diffraction temperature	140 ± 0.1 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0689
Residual factor for significantly intense reflections	0.0461
Weighted residual factors for significantly intense reflections	0.1071
Weighted residual factors for all reflections included in the refinement	0.1173
Goodness-of-fit parameter for all reflections included in the refinement	1.036
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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