Crystallography Open Database

Information card for entry 4328995

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Coordinates	4328995.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	mixed-valent (IV, VI) uranium methylenediphosphonate
Formula	C3 H6 O34 P6 U4
Calculated formula	C3 H6 O34 P6 U4
Title of publication	Mixed-Valent Uranium(IV,VI) Diphosphonate: Synthesis, Structure, and Spectroscopy
Authors of publication	Juan Diwu; Thomas E. Albrecht-Schmitt
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	4432 - 4434
a	25.903 ± 0.005 Å
b	17.021 ± 0.003 Å
c	16.723 ± 0.003 Å
α	90°
β	103.415 ± 0.002°
γ	90°
Cell volume	7172 ± 2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
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	0.0627
Residual factor for significantly intense reflections	0.0429
Weighted residual factors for significantly intense reflections	0.0963
Weighted residual factors for all reflections included in the refinement	0.1036
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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